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724701-44-4 | 1,2-Ethanediol, 1,2-bis(2-chlorophenyl)-, (1S,2S)-
CAS No: 724701-44-4 Catalog No: AG005HF9 MDL No:
Product Description
Catalog Number:
AG005HF9
Chemical Name:
1,2-Ethanediol, 1,2-bis(2-chlorophenyl)-, (1S,2S)-
CAS Number:
724701-44-4
Molecular Formula:
C14H12Cl2O2
Molecular Weight:
283.1499
IUPAC Name:
(1S,2S)-1,2-bis(2-chlorophenyl)ethane-1,2-diol
InChI:
InChI=1S/C14H12Cl2O2/c15-11-7-3-1-5-9(11)13(17)14(18)10-6-2-4-8-12(10)16/h1-8,13-14,17-18H/t13-,14-/m0/s1
InChI Key:
PRPZPQDFVUBHDN-KBPBESRZSA-N
SMILES:
O[C@H]([C@H](c1ccccc1Cl)O)c1ccccc1Cl
Properties
Complexity:
236
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
282.021g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
283.148g/mol
Monoisotopic Mass:
282.021g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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