CAS 3296-90-0|2,2-Bis(bromomethyl)-1,3-propanediol

Introduction:Basic information about CAS 3296-90-0|2,2-Bis(bromomethyl)-1,3-propanediol, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
Common Name2,2-Bis(bromomethyl)-1,3-propanediol
CAS Number3296-90-0Molecular Weight261.940
Density2.0±0.1 g/cm3Boiling Point370.9±42.0 °C at 760 mmHg
Molecular FormulaC5H10Br2O2Melting Point112-114 °C(lit.)
MSDSChineseUSAFlash Point178.1±27.9 °C
Symbol
GHS07, GHS08
Signal WordWarning

Names

Name2,2-Bis(bromomethyl)propane-1,3-diol
SynonymMore Synonyms

Chemical & Physical Properties

Density2.0±0.1 g/cm3
Boiling Point370.9±42.0 °C at 760 mmHg
Melting Point112-114 °C(lit.)
Molecular FormulaC5H10Br2O2
Molecular Weight261.940
Flash Point178.1±27.9 °C
Exact Mass259.904755
PSA40.46000
LogP0.38
Vapour Pressure0.0±1.9 mmHg at 25°C
Index of Refraction1.574
InChIKeyCHUGKEQJSLOLHL-UHFFFAOYSA-N
SMILESOCC(CO)(CBr)CBr

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
TY3195500
CHEMICAL NAME :
1,3-Propanediol, 2,2-bis(bromomethyl)-
CAS REGISTRY NUMBER :
3296-90-0
BEILSTEIN REFERENCE NO. :
1304582
LAST UPDATED :
199801
DATA ITEMS CITED :
19
MOLECULAR FORMULA :
C5-H10-Br2-O2
MOLECULAR WEIGHT :
261.97
WISWESSER LINE NOTATION :
Q1X1Q1E1E

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
1880 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
1200 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
109 gm/kg/13W-C
TOXIC EFFECTS :
Kidney, Ureter, Bladder - changes in tubules (including acute renal failure, acute tubular necrosis) Kidney, Ureter, Bladder - other changes Nutritional and Gross Metabolic - weight loss or decreased weight gain
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
9 gm/kg/30D-I
TOXIC EFFECTS :
Liver - changes in liver weight
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
73 gm/kg/2Y-C
TOXIC EFFECTS :
Sense Organs and Special Senses (Eye) - effect, not otherwise specified
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
36 gm/kg/13W-I
TOXIC EFFECTS :
Kidney, Ureter, Bladder - changes in tubules (including acute renal failure, acute tubular necrosis) Kidney, Ureter, Bladder - other changes Nutritional and Gross Metabolic - weight loss or decreased weight gain
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
72800 mg/kg/Y-C
TOXIC EFFECTS :
Tumorigenic - Carcinogenic by RTECS criteria Skin and Appendages - tumors
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
102 gm/kg/2Y-C
TOXIC EFFECTS :
Tumorigenic - Carcinogenic by RTECS criteria Lungs, Thorax, or Respiration - tumors
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Oral
DOSE :
124 gm/kg
SEX/DURATION :
male 15 week(s) pre-mating female 15 week(s) pre-mating
TOXIC EFFECTS :
Reproductive - Maternal Effects - parturition Reproductive - Fertility - litter size (e.g. # fetuses per litter; measured before birth) Reproductive - Effects on Newborn - other postnatal measures or effects
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Oral
DOSE :
62 gm/kg
SEX/DURATION :
female 15 week(s) pre-mating
TOXIC EFFECTS :
Reproductive - Fertility - female fertility index (e.g. # females pregnant per # sperm positive females; # females pregnant per # females mated) Reproductive - Effects on Newborn - other postnatal measures or effects
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Oral
DOSE :
62 gm/kg
SEX/DURATION :
male 15 week(s) pre-mating
TOXIC EFFECTS :
Reproductive - Paternal Effects - testes, epididymis, sperm duct Reproductive - Paternal Effects - prostate, seminal vesicle, Cowper's gland, accessory glands

MUTATION DATA

TYPE OF TEST :
Cytogenetic analysis
TEST SYSTEM :
Rodent - hamster Ovary
DOSE/DURATION :
800 mg/L
REFERENCE :
EMMUEG Environmental and Molecular Mutagenesis. (Alan R. Liss, Inc., 41 E. 11th St., New York, NY 10003) V.10- 1987- Volume(issue)/page/year: 10(Suppl 10),1,1987 *** REVIEWS *** TOXICOLOGY REVIEW FAATDF Fundamental and Applied Toxicology. (Academic Press, Inc., 1 E. First St., Duluth, MN 55802) V.1- 1981- Volume(issue)/page/year: 13,747,1989

Safety Information

Symbol
GHS07, GHS08
Signal WordWarning
Hazard StatementsH302-H315-H319-H335-H351
Precautionary StatementsP280-P301 + P312 + P330-P305 + P351 + P338
Personal Protective EquipmentEyeshields;full-face particle respirator type N100 (US);Gloves;respirator cartridge type N100 (US);type P1 (EN143) respirator filter;type P3 (EN 143) respirator cartridges
Hazard CodesT:Toxic;
Risk PhrasesR45;R36/37/38
Safety PhrasesS53-S23-S26-S36/37/39-S45-S36/37
RIDADR2811
WGK Germany3
RTECSTY3195500
HS Code2905590090

Customs

HS Code2905590090
Summary2905590090 other halogenated, sulphonated, nitrated or nitrosated derivatives of acyclic alcohols。Supervision conditions:None。VAT:17.0%。Tax rebate rate:9.0%。MFN tariff:5.5%。General tariff:30.0%

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Synonyms

FR 1138
Dibromopentaerythritol
Pentaerythritol dibromohydrin
2,2-Bis(bromomethyl)-1,3-propanediol
EINECS 221-967-7
MFCD00004688
Dibromoneopentyl Glycol
2,2-Bis(bromomethyl)propane-1,3-diol
1,3-Propanediol, 2,2-bis(bromomethyl)-
Pentaerythritol dibromide
CAS 1522-92-5|3-Bromo-2,2-bis(bromomethyl)propanol
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