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5-methylheptan-2-one

5-methylheptan-2-one structure

CAS No:
18217-12-4
Formula:
C8H16O
Chemical Name:
5-methylheptan-2-one
Synonyms:
5-METHYL-2-HEPTANONE;5-methylheptan-2-one;2-Heptanone, 5-methyl-;18217-12-4;5-methyl-heptan-2-one;SCHEMBL408474;DTXSID30939531;LMFA12000050;AKOS011384478;FT-0692773;Z2380469137

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5-methylheptan-2-one Basic Attributes

Molecular Weight：

128.21 g/mol

Exact Mass：

128.120115130 g/mol

Characteristics

PSA：

17.1 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.

5-methylheptan-2-one Use and Manufacturing

Use Classification：

Fatty Acyls [FA] -> Oxygenated hydrocarbons [FA12]

Computed Properties

Molecular Weight:128.21
XLogP3:2.4
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:4
Exact Mass:128.120115130
Monoisotopic Mass:128.120115130
Topological Polar Surface Area:17.1
Heavy Atom Count:9
Complexity:86.6
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 5-methylheptan-2-one

Basic Attributes
Characteristics
Safety Information
Use and Manufacturing
Computed Properties

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