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3-hydroxy-2-methylpentanal

3-hydroxy-2-methylpentanal structure

CAS No:
615-30-5
Formula:
C6H12O2
Chemical Name:
3-hydroxy-2-methylpentanal
Synonyms:
3-Hydroxy-2-methylpentanal;Pentanal, 3-hydroxy-2-methyl-;615-30-5;3-hydroxy-2-methyl-pentanal;NSC2621;2-Methyl-3-hydroxypentanal;3-Hydroxy-2-methylpentanal #;SCHEMBL1189342;3-hydroxy-2-methylpentan-1-one;DTXSID70277500;NSC-2621

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3-hydroxy-2-methylpentanal Basic Attributes

Molecular Weight：

116.16 g/mol

Exact Mass：

116.083729621 g/mol

NSC Number：

2621

DSSTox ID：

DTXSID70277500

Characteristics

PSA：

37.3 Å²

Safety Information

GHS Classification：

|Warning|H227 (100%): Combustible liquid [Warning Flammable liquids]|P210, P261, P264, P271, P280, P302+P352, 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:116.16
XLogP3:0.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:116.083729621
Monoisotopic Mass:116.083729621
Topological Polar Surface Area:37.3
Heavy Atom Count:8
Complexity:70.9
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3-hydroxy-2-methylpentanal

Basic Attributes
Characteristics
Safety Information
Computed Properties

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