 Home > Encyclopedia > 1-BUTYRYLIMIDAZOLE

1-BUTYRYLIMIDAZOLE

1-BUTYRYLIMIDAZOLE structure

CAS No:
4122-54-7
Formula:
C7H10N2O
Chemical Name:
1-BUTYRYLIMIDAZOLE
Synonyms:
1-(1H-imidazol-1-yl)butan-1-one;1-Butyrylimidazole;1-butyryl-1H-imidazole;1-imidazol-1-ylbutan-1-one;1-imidazolylbutan-1-one;SCHEMBL1775356;CTK4I4437;DTXSID50349173;1H-imidazole, 1-(1-oxobutyl)-;ZINC160300
Categories:
Pharmaceutical Intermediates > Bulk Drug Intermediates

Request for Quotation

1-BUTYRYLIMIDAZOLE Basic Attributes

Molecular Weight：

138.17

Exact Mass：

138.07900

DSSTox ID：

DTXSID50349173

HScode：

2933290090

Characteristics

PSA：

34.9

XLogP3：

1.32340

Density：

1.086 g/mL at 25ºC(lit.)

Boiling Point：

247.4ºC at 760 mmHg

Flash Point：

>230 °F

Refractive Index：

n20/D 1.496(lit.)

Safety Information

wgk germany：

hazard class code：

36/37/38

safety instructions：

26-36

Marks：

Precautionary statement(s)：

P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, P501

Hazard Statements：

H315

GHS Classification：

|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:138.17
XLogP3:0.5
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:138.079312947
Monoisotopic Mass:138.079312947
Topological Polar Surface Area:34.9
Heavy Atom Count:10
Complexity:125
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes