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53907-72-5 | 7-Octen-4-ol
CAS No: 53907-72-5 Catalog No: AG003ATE MDL No:MFCD16091601
Product Description
Catalog Number:
AG003ATE
Chemical Name:
7-Octen-4-ol
CAS Number:
53907-72-5
Molecular Formula:
C8H16O
Molecular Weight:
128.2120
MDL Number:
MFCD16091601
IUPAC Name:
oct-7-en-4-ol
InChI:
InChI=1S/C8H16O/c1-3-5-7-8(9)6-4-2/h3,8-9H,1,4-7H2,2H3
InChI Key:
MJWKMORBWQZWOT-UHFFFAOYSA-N
SMILES:
CCCC(CCC=C)O
Properties
Complexity:
69
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
128.12g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
128.215g/mol
Monoisotopic Mass:
128.12g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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