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13395-69-2 | 3,5-Dichloro-4'-methylbenzhydrol
CAS No: 13395-69-2 Catalog No: AG01FEN9 MDL No:MFCD06201237
Product Description
Catalog Number:
AG01FEN9
Chemical Name:
3,5-Dichloro-4'-methylbenzhydrol
CAS Number:
13395-69-2
Molecular Formula:
C14H12Cl2O
Molecular Weight:
267.1505
MDL Number:
MFCD06201237
IUPAC Name:
(3,5-dichlorophenyl)-(4-methylphenyl)methanol
InChI:
InChI=1S/C14H12Cl2O/c1-9-2-4-10(5-3-9)14(17)11-6-12(15)8-13(16)7-11/h2-8,14,17H,1H3
InChI Key:
NMVBRPABOXWOCI-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)C(c1cc(Cl)cc(c1)Cl)O
Properties
Complexity:
228
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
266.027g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
267.149g/mol
Monoisotopic Mass:
266.027g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4.4
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