2-methyl-1-hexadecanol

2-methyl-1-hexadecanol
Compound Structure:
Synonyms: 2-METHYL-1-HEXADECANOL;2-Methylhexadecan-1-ol;2490-48-4;68526-87-4;1-Hexadecanol, 2-methyl-;2-Methyl-1-hexadecanol
Compound ID: NMPC-259
PubChem ID:

17218
Molecular Formula: C17H36O
Canonical SMILES: CCCCCCCCCCCCCCC(C)CO
InChIKey: FCSBKDJGLIURSH-UHFFFAOYSA-N
About the compound:

GHS Hazard Statements

• H226 (99.72%): Flammable liquid and vapor [Warning Flammable liquids]

• H314 (99.96%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]

• H318 (14.58%): Causes serious eye damage [Danger Serious eye damage/eye irritation]
Properties:

Chemical and Physical Properties

Property Name

Property Value

Molecular Weight

256.5 g/mol

XLogP3-AA

7.7

Hydrogen Bond Donor Count

1

Hydrogen Bond Acceptor Count

1

Rotatable Bond Count

14

Exact Mass

256.276615768 g/mol

Monoisotopic Mass

256.276615768 g/mol

Topological Polar Surface Area

20.2Ų

Heavy Atom Count

18

Formal Charge

0

Complexity

145

Isotope Atom Count

0

Defined Atom Stereocenter Count

0

Undefined Atom Stereocenter Count

1

Defined Bond Stereocenter Count

0

Undefined Bond Stereocenter Count

0

Covalently-Bonded Unit Count

1

Compound Is Canonicalized

Yes

Source: PubChem
Source Species: Euphorbia hirta
Mariscus alternifolius
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