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89358-81-6 | 1,2-Cyclohexanediol, 1-[(diphenylphosphinyl)methyl]-
CAS No: 89358-81-6 Catalog No: AG003X5T MDL No:
Product Description
Catalog Number:
AG003X5T
Chemical Name:
1,2-Cyclohexanediol, 1-[(diphenylphosphinyl)methyl]-
CAS Number:
89358-81-6
Molecular Formula:
C19H23O3P
Molecular Weight:
330.3579
IUPAC Name:
1-(diphenylphosphorylmethyl)cyclohexane-1,2-diol
InChI:
InChI=1S/C19H23O3P/c20-18-13-7-8-14-19(18,21)15-23(22,16-9-3-1-4-10-16)17-11-5-2-6-12-17/h1-6,9-12,18,20-21H,7-8,13-15H2
InChI Key:
GHBLFYKTNSNUGN-UHFFFAOYSA-N
SMILES:
OC1CCCCC1(O)CP(=O)(c1ccccc1)c1ccccc1
Properties
Complexity:
404
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
330.138g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
330.364g/mol
Monoisotopic Mass:
330.138g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
57.5A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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