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1215-74-3 | Phenol, 2,2'-methylenebis[5-chloro-
CAS No: 1215-74-3 Catalog No: AG00152W MDL No:
Product Description
Catalog Number:
AG00152W
Chemical Name:
Phenol, 2,2'-methylenebis[5-chloro-
CAS Number:
1215-74-3
Molecular Formula:
C13H10Cl2O2
Molecular Weight:
269.1233
IUPAC Name:
5-chloro-2-[(4-chloro-2-hydroxyphenyl)methyl]phenol
InChI:
InChI=1S/C13H10Cl2O2/c14-10-3-1-8(12(16)6-10)5-9-2-4-11(15)7-13(9)17/h1-4,6-7,16-17H,5H2
InChI Key:
PMYWWZKCZCXDPU-UHFFFAOYSA-N
SMILES:
Clc1ccc(c(c1)O)Cc1ccc(cc1O)Cl
NSC Number:
3947
Properties
Complexity:
226
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
268.006g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
269.121g/mol
Monoisotopic Mass:
268.006g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.4
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