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1772-53-8 | Hexanedioic acid, 3,4-bis(4-chlorophenyl)-
CAS No: 1772-53-8 Catalog No: AG00255Y MDL No:
Product Description
Catalog Number:
AG00255Y
Chemical Name:
Hexanedioic acid, 3,4-bis(4-chlorophenyl)-
CAS Number:
1772-53-8
Molecular Formula:
C18H16Cl2O4
Molecular Weight:
367.2232
IUPAC Name:
3,4-bis(4-chlorophenyl)hexanedioic acid
InChI:
InChI=1S/C18H16Cl2O4/c19-13-5-1-11(2-6-13)15(9-17(21)22)16(10-18(23)24)12-3-7-14(20)8-4-12/h1-8,15-16H,9-10H2,(H,21,22)(H,23,24)
InChI Key:
GUQHSNHAMGACCO-UHFFFAOYSA-N
SMILES:
OC(=O)CC(C(c1ccc(cc1)Cl)CC(=O)O)c1ccc(cc1)Cl
NSC Number:
77733
Properties
Complexity:
387
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
366.043g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
367.222g/mol
Monoisotopic Mass:
366.043g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
74.6A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
4
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