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150956-50-6 | 2-Cyclohexen-1-ol, 2-(1-methylethyl)-4-(1-methylethylidene)-
CAS No: 150956-50-6 Catalog No: AG0023WY MDL No:
Product Description
Catalog Number:
AG0023WY
Chemical Name:
2-Cyclohexen-1-ol, 2-(1-methylethyl)-4-(1-methylethylidene)-
CAS Number:
150956-50-6
Molecular Formula:
C12H20O
Molecular Weight:
180.2866
IUPAC Name:
2-propan-2-yl-4-propan-2-ylidenecyclohex-2-en-1-ol
InChI:
InChI=1S/C12H20O/c1-8(2)10-5-6-12(13)11(7-10)9(3)4/h7,9,12-13H,5-6H2,1-4H3
InChI Key:
CYOJESZRZNCQEV-UHFFFAOYSA-N
SMILES:
CC(C1=CC(=C(C)C)CCC1O)C
Properties
Complexity:
242
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
180.151g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
180.291g/mol
Monoisotopic Mass:
180.151g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
Literature
| Title | Journal |
|---|---|
| Inhibition of HIV-1 replication by combination of a novel inhibitor of TNF-alpha with AZT. | Journal of acquired immune deficiency syndromes and human retrovirology : official publication of the International Retrovirology Association 19980815 |
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