Hexadecanediol

HCID 656980
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Basic information

CAS
50986-41-9
Standard SMILES
CCCCCCCCCCCCCCCC(O)O
InChIKey
SRYDOKOCKWANAE-UHFFFAOYSA-N
Molecular formula
C16H34O2
Average molar mass
258.44 g/mol
Monoisotopic mass
258.25588033

Names & identifiers

Preferred name
Hexadecanediol
IUPAC
hexadecane-1,1-diol

Names & synonyms

Hexadecanediol50986-41-9DTXSID90349677RefChem:347439DTXCID30300747hexadecane-1,1-diolhexadecane diolSCHEMBL318856SCHEMBL1768652SCHEMBL27748657SRYDOKOCKWANAE-UHFFFAOYSA-N

Database identifiers

CAS
50986-41-9
PubChem CID
656980
DTXSID
DTXSID90349677

Properties

Computed structural propertiesFilling in

XLogP
6.8
Topological polar surface area
40.5 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
2
Rotatable bonds
14
Heavy atoms
18

Related reactions

1 records
New reaction record

Compound notes

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