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1-hydroxy-3-methylbutan-2-one

1-hydroxy-3-methylbutan-2-one structure

CAS No:
36960-22-2
Formula:
C5H10O2
Chemical Name:
1-hydroxy-3-methylbutan-2-one
Synonyms:
1-hydroxy-3-methylbutan-2-one;36960-22-2;1-HYDROXY-3-METHYL-2-BUTANONE;1-HYDROXY-3-METHYL-BUTAN-2-ONE;2-Butanone, 1-hydroxy-3-methyl-;SCHEMBL800918;DTXSID80190458;ZINC2008288;MFCD18968789;AKOS016355156;MCULE-8746789873;NE48676;NS-01002

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1-hydroxy-3-methylbutan-2-one Basic Attributes

Molecular Weight：

102.13 g/mol

Exact Mass：

102.068079557 g/mol

DSSTox ID：

DTXSID80190458

Characteristics

PSA：

37.3 Å²

Safety Information

GHS Classification：

|Warning|H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]|P210, P233, P240, P241, P242, P243, P261, P264, P271, P280, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P370+P378, P403+P233, P403+P235, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:102.13
XLogP3:0.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:102.068079557
Monoisotopic Mass:102.068079557
Topological Polar Surface Area:37.3
Heavy Atom Count:7
Complexity:66.5
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-hydroxy-3-methylbutan-2-one

Basic Attributes
Characteristics
Safety Information
Computed Properties

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