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Trimethylene carbonate

Trimethylene carbonate structure

CAS No:
2453-03-4
Formula:
C4H6O3
Chemical Name:
Trimethylene carbonate
Synonyms:
1,3-Dioxan-2-one;Carbonic acid,cyclic trimethylene ester;Carbonic acid,trimethylene ester;1,3-Propanediol,cyclic carbonate;m-Dioxan-2-one;Trimethylene carbonate;1,3-Propylene carbonate;Cyclic trimethylene carbonate;1,3-Carbonyldioxypropane;2-Oxo-1,3-dioxane;Cyclo(trimethylene carbonate);m-Dioxanone;335169-11-4
Categories:
Pharmaceutical Intermediates > Bulk Drug Intermediates

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Trimethylene carbonate Basic Attributes

Molecular Weight：

102.08900

Exact Mass：

102.09

EC Number：

608-674-3

UNII：

4316AQ174Q

HScode：

2932999099

Characteristics

PSA：

35.53000

XLogP3：

0.54330

Density：

1.2g/cm3

Melting Point：

47-48 °C

Boiling Point：

160-165 °C

Flash Point：

148.6ºC

Refractive Index：

1.425

Safety Information

safety instructions：

24/25

Precautionary statement(s)：

P264, P270, P280, P301+P312, P305+P351+P338, P330, P337+P313, P501

Hazard Statements：

H302

GHS Classification：

|Warning|H302 (95.24%): Harmful if swallowed [Warning Acute toxicity, oral]|P264, P270, P280, P301+P312, P305+P351+P338, P330, P337+P313, and P501|Aggregated GHS information provided by 43 companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Drug Information

MeSH Entry Terms：

1,3-carbonyldioxypropane

Computed Properties

Molecular Weight:102.09
XLogP3:0.7
Hydrogen Bond Acceptor Count:3
Exact Mass:102.031694049
Monoisotopic Mass:102.031694049
Topological Polar Surface Area:35.5
Heavy Atom Count:7
Complexity:71
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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