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100692-55-5 | 1-Cyclohexene-1-methanol, 4-(1-methylethyl)-, (4S)-
CAS No: 100692-55-5 Catalog No: AG0002MV MDL No:
Product Description
Catalog Number:
AG0002MV
Chemical Name:
1-Cyclohexene-1-methanol, 4-(1-methylethyl)-, (4S)-
CAS Number:
100692-55-5
Molecular Formula:
C10H18O
Molecular Weight:
154.2493
IUPAC Name:
[(4S)-4-propan-2-ylcyclohexen-1-yl]methanol
InChI:
InChI=1S/C10H18O/c1-8(2)10-5-3-9(7-11)4-6-10/h3,8,10-11H,4-7H2,1-2H3/t10-/m1/s1
InChI Key:
FFOYLHBMVUGHSX-SNVBAGLBSA-N
SMILES:
OCC1=CC[C@H](CC1)C(C)C
Properties
Complexity:
147
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
154.136g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
154.253g/mol
Monoisotopic Mass:
154.136g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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