Trimethylamine oxide dihydrate

Modify Date: 2025-08-25 09:32:53

Trimethylamine oxide dihydrate Structure
Trimethylamine oxide dihydrate structure
Common Name Trimethylamine oxide dihydrate
CAS Number 62637-93-8 Molecular Weight 111.140
Density 1.157 g/cm3 Boiling Point N/A
Molecular Formula C3H13NO3 Melting Point 95-99 °C(lit.)
MSDS Chinese USA Flash Point 95 °C
Symbol GHS07
GHS07
Signal Word Warning

 Names

Name Trimethylamine N-oxide dihydrate
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.157 g/cm3
Melting Point 95-99 °C(lit.)
Molecular Formula C3H13NO3
Molecular Weight 111.140
Flash Point 95 °C
Exact Mass 111.089546
PSA 47.89000
LogP 0.08270
InChIKey PGFPZGKEDZGJQZ-UHFFFAOYSA-N
SMILES C[N+](C)(C)[O-].O.O

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
YH2850000
CHEMICAL NAME :
Trimethylamine oxide, dihydrate
CAS REGISTRY NUMBER :
62637-93-8
LAST UPDATED :
199012
DATA ITEMS CITED :
3
MOLECULAR FORMULA :
C3-H9-N-O.2H2-O
MOLECULAR WEIGHT :
111.17
WISWESSER LINE NOTATION :
ON1&1&1 &QH 2

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
Standard Draize test
ROUTE OF EXPOSURE :
Administration into the eye
SPECIES OBSERVED :
Rodent - rabbit
REFERENCE :
28ZPAK "Sbornik Vysledku Toxixologickeho Vysetreni Latek A Pripravku," Marhold, J.V., Institut Pro Vychovu Vedoucicn Pracovniku Chemickeho Prumyclu Praha, Czechoslovakia, 1972 Volume(issue)/page/year: -,74,1972 ** ACUTE TOXICITY DATA **
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
8700 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
28ZPAK "Sbornik Vysledku Toxixologickeho Vysetreni Latek A Pripravku," Marhold, J.V., Institut Pro Vychovu Vedoucicn Pracovniku Chemickeho Prumyclu Praha, Czechoslovakia, 1972 Volume(issue)/page/year: -,74,1972
TYPE OF TEST :
LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE :
Subcutaneous
SPECIES OBSERVED :
Rodent - rabbit
DOSE/DURATION :
3 gm/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
HBAMAK "Abdernalden's Handbuch der Biologischen Arbeitsmethoden." (Leipzig, Ger. Dem. Rep.) Volume(issue)/page/year: 4,1289,1935

 Safety Information

Symbol GHS07
GHS07
Signal Word Warning
Hazard Statements H315-H319
Precautionary Statements P305 + P351 + P338
Personal Protective Equipment dust mask type N95 (US);Eyeshields;Gloves
Hazard Codes Xi:Irritant;
Risk Phrases R36/38
Safety Phrases S26-S36-S37/39
RIDADR NONH for all modes of transport
WGK Germany 2
RTECS YH2850000

 Synonyms

EINECS 214-675-6
MFCD00149077
Trimethylamine oxide dihydrate
Amine oxide, trimethyl-, hydrate (1:2)
N,N-dimethylmethanamine oxide,dihydrate
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