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Home > Other Building Blocks > 160790-49-8
160790-49-8 | 4-Octene-2,7-diol, 2,7-dimethyl-, (4Z)-
CAS No: 160790-49-8 Catalog No: AG001VCM MDL No:
Product Description
Catalog Number:
AG001VCM
Chemical Name:
4-Octene-2,7-diol, 2,7-dimethyl-, (4Z)-
CAS Number:
160790-49-8
Molecular Formula:
C10H20O2
Molecular Weight:
172.2646
IUPAC Name:
2,7-dimethyloct-4-ene-2,7-diol
InChI:
InChI=1S/C10H20O2/c1-9(2,11)7-5-6-8-10(3,4)12/h5-6,11-12H,7-8H2,1-4H3
InChI Key:
LQBJEGDVJSXOJN-UHFFFAOYSA-N
SMILES:
CC(C/C=C\CC(O)(C)C)(O)C
Properties
Complexity:
139
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
172.146g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
172.268g/mol
Monoisotopic Mass:
172.146g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
1.3
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