CAS 133-32-4|3-Indolebutyric acid

Introduction:Basic information about CAS 133-32-4|3-Indolebutyric acid, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
Common Name3-Indolebutyric acid
CAS Number133-32-4Molecular Weight203.237
Density1.3±0.1 g/cm3Boiling Point426.6±20.0 °C at 760 mmHg
Molecular FormulaC12H13NO2Melting Point124-125.5 °C(lit.)
MSDSChineseUSAFlash Point211.8±21.8 °C
Symbol
GHS06
Signal WordDanger

Names

Nameindole-3-butyric acid
SynonymMore Synonyms

3-Indolebutyric acid BiologicalActivity

DescriptionIndole-3-butyric acid (3-indolebutyric acid; IBA) is a plant growth auxin and a good rooting agent. It can promote herbs and woody ornamental plant rooting and used for improving fruit rate.
Related CatalogSignaling Pathways >>Others >>OthersNatural Products >>AlkaloidBiochemical Assay ReagentsResearch Areas >>Others

Chemical & Physical Properties

Density1.3±0.1 g/cm3
Boiling Point426.6±20.0 °C at 760 mmHg
Melting Point124-125.5 °C(lit.)
Molecular FormulaC12H13NO2
Molecular Weight203.237
Flash Point211.8±21.8 °C
Exact Mass203.094635
PSA53.09000
LogP2.34
Vapour Pressure0.0±1.1 mmHg at 25°C
Index of Refraction1.646
InChIKeyJTEDVYBZBROSJT-UHFFFAOYSA-N
SMILESO=C(O)CCCc1c[nH]c2ccccc12
Storage condition2-8°C
StabilityStable. Incompatible with strong oxidizing agents. Light sensitive.

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
NL5250000
CHEMICAL NAME :
1H-Indole-3-butanoic acid
CAS REGISTRY NUMBER :
133-32-4
BEILSTEIN REFERENCE NO. :
0171120
LAST UPDATED :
199701
DATA ITEMS CITED :
9
MOLECULAR FORMULA :
C12-H13-N-O2
MOLECULAR WEIGHT :
203.26
WISWESSER LINE NOTATION :
T56 BMJ D3VQ

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD - Lethal dose
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
>500 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 :
100 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 :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
100 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value

MUTATION DATA

TYPE OF TEST :
Mutation test systems - not otherwise specified
TEST SYSTEM :
Human Leukocyte
DOSE/DURATION :
100 nmol/L
REFERENCE :
EXPEAM Experientia. (Birkhaeuser Verlag, POB 133, CH-4010 Basel, Switzerland) V.1- 1945- Volume(issue)/page/year: 32,29,1976 *** U.S. STANDARDS AND REGULATIONS *** EPA FIFRA 1988 PESTICIDE SUBJECT TO REGISTRATION OR RE-REGISTRATION FEREAC Federal Register. (U.S. Government Printing Office, Supt. of Documents, Washington, DC 20402) V.1- 1936- Volume(issue)/page/year: 54,7740,1989 *** NIOSH STANDARDS DEVELOPMENT AND SURVEILLANCE DATA *** NIOSH OCCUPATIONAL EXPOSURE SURVEY DATA : NOES - National Occupational Exposure Survey (1983) NOES Hazard Code - X1123 No. of Facilities: 144 (estimated) No. of Industries: 1 No. of Occupations: 1 No. of Employees: 864 (estimated)

Safety Information

Symbol
GHS06
Signal WordDanger
Hazard StatementsH301-H315-H319-H335
Precautionary StatementsP261-P301 + P310-P305 + P351 + P338
Personal Protective EquipmentEyeshields;Faceshields;Gloves;type P2 (EN 143) respirator cartridges
Hazard CodesT:Toxic
Risk PhrasesR25;R36/37/38
Safety PhrasesS26-S36-S45-S38-S36/37/39-S28A
RIDADRUN 2811 6.1/PG 3
WGK Germany3
RTECSNL5250000
Packaging GroupIII
Hazard Class6.1
HS Code2942000000

Customs

HS Code2933990090
Summary2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

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Synonyms

beta-indolebutyricacid
3-INDOLEBUTYVIC ACID
4-(3-Indolyl)-butyric acid
EINECS 205-101-5
3-indolyl-gamma-butyricacid
4-(indolyl)-butyricaci
1h-indole-3-butanoicacid
IBA
4-indolylbutyric acid
3-IndolybutYHic acid
4-(3-INDOLE)-BUTYRIC ACID
4-(3-Indolyl)butyric acid
Indole-3 Butyric acid
gamma-(indol-3-yl)butyricacid
4-indol-3-ylbutanoic acid
1H-INDOLE-3-BUTYRICACID
3-Indolebutyric Acid(Iba)
Seradix
4-(3-Indolyl)butyric acid (4-(3-Indolyl)butanoic acid
INDOLE 3 BUTYRIC ACID
INDOLEBUTYRIC ACID
4-(3-INDOLE)BUTYRIC ACID
4-(3-Indolyl)butanoic acid
4-(indol-3-yl)butyricacid
3-METHYL-2-PHENYLPYRIDINE
gamma-(3-indolyl)butyricacid
3-Indolebutyric acid
4-(1H-Indol-3-yl)butanoic acid
T56 BMJ D3VQ
Indole-3-butyric acid
Indole 3-butyric acid
3-INDOLE BUTYRIC ACID
3-Indolebutyricacid
1H-Indole-3-butanoic acid
4-(1H-indol-3-yl)butyric acid
3-IODOLEBUTYRIC ACID
MFCD00005664
3-Indolybutyric acid
3-INDOLBUTYRIC ACID
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