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Related CAS#:

513-44-0

513-44-0 structure
513-44-0 structure

Name Isobutylmercaptan
Synonyms 2-Methyl-1-propanethiol
Isobutyl Mercaptan
Isobutylmercaptan
2-Methylpropane-1-thiol
1-ISOBUTANETHIOL
Isobutanethiol
1-Propanethiol, 2-methyl-
2-methylpropanethiol
MFCD00004882
Isobutyl thiol
EINECS 208-162-6
Density 0.8±0.1 g/cm3
Boiling Point 86.6±8.0 °C at 760 mmHg
Melting Point -145°C
Molecular Formula C4H10S
Molecular Weight 90.187
Flash Point -9.4±0.0 °C
Exact Mass 90.050323
PSA 38.80000
LogP 2.13
Vapour density 3.1 (vs air)
Vapour Pressure 74.1±0.2 mmHg at 25°C
Index of Refraction 1.435

CHEMICAL IDENTIFICATION

RTECS NUMBER :
TZ7630000
CHEMICAL NAME :
1-Propanethiol, 2-methyl-
CAS REGISTRY NUMBER :
513-44-0
BEILSTEIN REFERENCE NO. :
1730890
LAST UPDATED :
199709
DATA ITEMS CITED :
4
MOLECULAR FORMULA :
C4-H10-S
MOLECULAR WEIGHT :
90.20
WISWESSER LINE NOTATION :
SH1Y1&1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
Standard Draize test
ROUTE OF EXPOSURE :
Administration into the eye
SPECIES OBSERVED :
Rodent - rabbit
REFERENCE :
AIHAAP American Industrial Hygiene Association Journal. (AIHA, 475 Wolf Ledges Pkwy., Akron, OH 44311) V.19- 1958- Volume(issue)/page/year: 19,171,1958 ** ACUTE TOXICITY DATA **
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
7168 mg/kg
TOXIC EFFECTS :
Behavioral - muscle weakness Behavioral - ataxia Lungs, Thorax, or Respiration - cyanosis
REFERENCE :
AIHAAP American Industrial Hygiene Association Journal. (AIHA, 475 Wolf Ledges Pkwy., Akron, OH 44311) V.19- 1958- Volume(issue)/page/year: 19,171,1958
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
917 mg/kg
TOXIC EFFECTS :
Peripheral Nerve and Sensation - spastic paralysis with or without sensory change Behavioral - excitement Lungs, Thorax, or Respiration - cyanosis
REFERENCE :
AIHAAP American Industrial Hygiene Association Journal. (AIHA, 475 Wolf Ledges Pkwy., Akron, OH 44311) V.19- 1958- Volume(issue)/page/year: 19,171,1958
Symbol GHS02 GHS07
GHS02, GHS07
Signal Word Danger
Hazard Statements H225-H315-H319-H335
Precautionary Statements P210-P261-P305 + P351 + P338
Personal Protective Equipment Eyeshields;Faceshields;full-face respirator (US);Gloves;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter
Hazard Codes F: Flammable;Xi: Irritant;
Risk Phrases R11
Safety Phrases S16-S26-S36
RIDADR UN 2347 3/PG 2
WGK Germany 3
RTECS TZ7630000
Packaging Group II
Hazard Class 3.1
HS Code 2930909090
HS Code 2930909090
Summary 2930909090. other organo-sulphur compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%