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24893-97-8 | 4-Cyclohexene-1,3-dimethanol, cis- (8CI,9CI)
CAS No: 24893-97-8 Catalog No: AG002PSG MDL No:
Product Description
Catalog Number:
AG002PSG
Chemical Name:
4-Cyclohexene-1,3-dimethanol, cis- (8CI,9CI)
CAS Number:
24893-97-8
Molecular Formula:
C8H14O2
Molecular Weight:
142.1956
IUPAC Name:
[(1S,5S)-5-(hydroxymethyl)cyclohex-3-en-1-yl]methanol
InChI:
InChI=1S/C8H14O2/c9-5-7-2-1-3-8(4-7)6-10/h1-2,7-10H,3-6H2/t7-,8+/m1/s1
InChI Key:
GPSADGUPABLTIH-SFYZADRCSA-N
SMILES:
OC[C@H]1CC=C[C@H](C1)CO
Properties
Complexity:
120
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
142.099g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
142.198g/mol
Monoisotopic Mass:
142.099g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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