CAS 99-91-2|1-(4-Chlorophenyl)ethanone

Introduction:Basic information about CAS 99-91-2|1-(4-Chlorophenyl)ethanone, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
Common Name1-(4-Chlorophenyl)ethanone
CAS Number99-91-2Molecular Weight154.594
Density1.2±0.1 g/cm3Boiling Point237.7±13.0 °C at 760 mmHg
Molecular FormulaC8H7ClOMelting Point74-76 °C(lit.)
MSDSUSAFlash Point107.1±11.0 °C
Symbol
GHS05, GHS06
Signal WordDanger

Names

Name4'-Chloroacetophenone
SynonymMore Synonyms

Chemical & Physical Properties

Density1.2±0.1 g/cm3
Boiling Point237.7±13.0 °C at 760 mmHg
Melting Point74-76 °C(lit.)
Molecular FormulaC8H7ClO
Molecular Weight154.594
Flash Point107.1±11.0 °C
Exact Mass154.018539
PSA17.07000
LogP2.35
Vapour Pressure0.0±0.5 mmHg at 25°C
Index of Refraction1.532
InChIKeyBUZYGTVTZYSBCU-UHFFFAOYSA-N
SMILESCC(=O)c1ccc(Cl)cc1
Water Solubility111 mg/L (25 ºC)

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
KM5600000
CHEMICAL NAME :
Ethanone, 1-(4-chlorophenyl)-
CAS REGISTRY NUMBER :
99-91-2
BEILSTEIN REFERENCE NO. :
0386014
LAST UPDATED :
199709
DATA ITEMS CITED :
7
MOLECULAR FORMULA :
C8-H7-Cl-O
MOLECULAR WEIGHT :
154.60
WISWESSER LINE NOTATION :
GR DV1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
TCLo - Lowest published toxic concentration
ROUTE OF EXPOSURE :
Inhalation
SPECIES OBSERVED :
Human
DOSE/DURATION :
1 mg/m3/1M
TOXIC EFFECTS :
Sense Organs and Special Senses (Olfaction) - effect, not otherwise specified Sense Organs and Special Senses (Eye) - lacrimation Sense Organs and Special Senses (Eye) - effect, not otherwise specified
REFERENCE :
27ZZA9 "Manual of Pharmacology and Its Applications to Therapeutics and Toxicology," 8th ed., Sollman, T., Philadelphia, W.B. Saunders Co., 1957 Volume(issue)/page/year: 8,192,1957
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
1207 mg/kg
TOXIC EFFECTS :
Peripheral Nerve and Sensation - flaccid paralysis without anesthesia (usually neuromuscular blockage) Behavioral - muscle weakness Lungs, Thorax, or Respiration - respiratory depression
REFERENCE :
PHARAT Pharmazie. (VEB Verlag Volk und Gesundheit, Neue Gruenstr. 18, Berlin DDR-1020, Ger. Dem. Rep.) V.1- 1946- Volume(issue)/page/year: 31,317,1976
TYPE OF TEST :
LC50 - Lethal concentration, 50 percent kill
ROUTE OF EXPOSURE :
Inhalation
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
1752 mg/m3/15M
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
JJATDK JAT, Journal of Applied Toxicology. (John Wiley & Sons Ltd., Baffins Lane, Chichester, W. Sussex PO19 1UD, UK) V.1- 1981- Volume(issue)/page/year: 14,411,1994
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
100 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
NTIS** National Technical Information Service. (Springfield, VA 22161) Formerly U.S. Clearinghouse for Scientific & Technical Information. Volume(issue)/page/year: AD277-689 ** OTHER MULTIPLE DOSE TOXICITY DATA **
TYPE OF TEST :
TCLo - Lowest published toxic concentration
ROUTE OF EXPOSURE :
Inhalation
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
87600 ug/m3/15M/10D-I
TOXIC EFFECTS :
Lungs, Thorax, or Respiration - acute pulmonary edema Endocrine - hyperglycemia Endocrine - changes in spleen weight
REFERENCE :
JJATDK JAT, Journal of Applied Toxicology. (John Wiley & Sons Ltd., Baffins Lane, Chichester, W. Sussex PO19 1UD, UK) V.1- 1981- Volume(issue)/page/year: 14,411,1994 *** NIOSH STANDARDS DEVELOPMENT AND SURVEILLANCE DATA *** NIOSH OCCUPATIONAL EXPOSURE SURVEY DATA : NOES - National Occupational Exposure Survey (1983) NOES Hazard Code - X7067 No. of Facilities: 7 (estimated) No. of Industries: 1 No. of Occupations: 1 No. of Employees: 28 (estimated)

Safety Information

Symbol
GHS05, GHS06
Signal WordDanger
Hazard StatementsH302-H315-H318-H330-H335
Precautionary StatementsP260-P280-P284-P305 + P351 + P338-P310
Personal Protective EquipmentEyeshields;Faceshields;full-face respirator (US);Gloves;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter
Hazard CodesT+,Xn
Risk PhrasesR26;R36/37/38
Safety PhrasesS26-S28-S36/37/39-S45-S28A
RIDADRUN 3416 6.1/PG 2
WGK Germany3
RTECSKM5600000
Packaging GroupII
Hazard Class6.1
HS Code29147090

Customs

HS Code2914700090
SummaryHS: 2914700090 halogenated, sulphonated, nitrated or nitrosated derivatives of ketones and quinones, whether or not with other oxygen function Tax rebate rate:9.0% Supervision conditions:none VAT:17.0% MFN tariff:5.5% General tariff:30.0%

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Synonyms

4-acetylchlorobenzene
P-CHLOROACETOPHENONE
MFCD00000622
1-(4-chlorophenyl)ethan-1-one
1-(4-Chlorophenyl)ethanone
EINECS 202-800-7
4′-Chloroacetophenone
Acetophenone, 4'-chloro-
CHLOROACETOPHENONE-4
Acetophenone, 4'-chloro- (8CI)
4-Chloroacetophenone
4'-Chloroacetophenone
4-chlorophenyl methyl ketone
p-Chloracetophenone
usafdo-1
para-chloroacetophenone
Ethanone, 1-(4-chlorophenyl)-
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