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Pivalic anhydride

Pivalic anhydride structure

CAS No:
1538-75-6
Formula:
C10H18O3
Chemical Name:
Pivalic anhydride
Synonyms:
Propanoic acid,2,2-dimethyl-,1,1′-anhydride;Pivalic anhydride;Propanoic acid,2,2-dimethyl-,anhydride;Trimethylacetic acid anhydride;2,2-Dimethylpropanoic anhydride;Trimethylacetic anhydride;Pivalic acid anhydride;Pivaloyl anhydride;2,2-Dimethylpropionic anhydride;2,2-Dimethylpropanoic acid anhydride;Neopentanoic anhydride;2,2,2-Trimethylacetic anhydride;2,2-Dimethylpropanoyl anhydride;2,2-Dimethylpropanoyl 2,2-dimethylpropanoate
Categories:
Chemical Reagents > Organic Reagents

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Pivalic anhydride Basic Attributes

Molecular Weight：

186.24800

Exact Mass：

186.25

EC Number：

216-263-1

HScode：

2942000000

Characteristics

PSA：

43.37000

XLogP3：

2.14840

Density：

0.918

Boiling Point：

193 °C

Flash Point：

57ºC

Refractive Index：

1.409

Storage Conditions：

Store at RT.

Vapor Pressure：

0.475mmHg at 25°C

Safety Information

Packing level：

Hazard category：

Transport codes：

UN 2920

wgk germany：

hazard class code：

R34

safety instructions：

S26-S36/37/39-S45

Marks：

Precautionary statement(s)：

P280-P305 + P351 + P338-P310

Hazard Statements：

H226-H314

GHS Classification：

|Danger|H226 (87.23%): Flammable liquid and vapor [Warning Flammable liquids]|P210, P233, P240, P241, P242, P243, P260, P264, P280, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P363, P370+P378, P403+P235, P405, and P501|Aggregated GHS information provided by 47 companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Drug Information

MeSH Entry Terms：

pivalic anhydride

Pivalic anhydride Use and Manufacturing

Uses

A metabolite of a double prodrug (6-dGCV-DPiv

Manufacturing Info：

Propanoic acid, 2,2-dimethyl-, 1,1'-anhydride: ACTIVE

Computed Properties

Molecular Weight:186.25
XLogP3:2.7
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:186.125594432
Monoisotopic Mass:186.125594432
Topological Polar Surface Area:43.4
Heavy Atom Count:13
Complexity:191
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Material

Benzyl alcohol

Toluene

Sodium formate

tert-Butanol

Benzoyl chloride

Downstream Products

Benzaldehyde

Benzoic acid

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