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Home > Other Heterocycles > 90165-84-7
90165-84-7 | 4-Hexen-3-ol, 6-(6,6-dimethylbicyclo[3.1.1]hept-2-yl)-
CAS No: 90165-84-7 Catalog No: AG006HWD MDL No:
Product Description
Catalog Number:
AG006HWD
Chemical Name:
4-Hexen-3-ol, 6-(6,6-dimethylbicyclo[3.1.1]hept-2-yl)-
CAS Number:
90165-84-7
Molecular Formula:
C15H26O
Molecular Weight:
222.3663
IUPAC Name:
6-(6,6-dimethyl-2-bicyclo[3.1.1]heptanyl)hex-4-en-3-ol
InChI:
InChI=1S/C15H26O/c1-4-13(16)7-5-6-11-8-9-12-10-14(11)15(12,2)3/h5,7,11-14,16H,4,6,8-10H2,1-3H3
InChI Key:
JJEDHOJMPIZRPR-UHFFFAOYSA-N
SMILES:
CCC(C=CCC1CCC2CC1C2(C)C)O
Properties
Complexity:
267
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.198g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
222.372g/mol
Monoisotopic Mass:
222.198g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
4
Undefined Bond Stereocenter Count:
1
XLogP3:
4.4
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