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86762-55-2 | Phenol, 4-chloro-2-[(dimethylamino)methyl]-5-methyl-
CAS No: 86762-55-2 Catalog No: AG004N7Y MDL No:
Product Description
Catalog Number:
AG004N7Y
Chemical Name:
Phenol, 4-chloro-2-[(dimethylamino)methyl]-5-methyl-
CAS Number:
86762-55-2
Molecular Formula:
C10H14ClNO
Molecular Weight:
199.6773
IUPAC Name:
4-chloro-2-[(dimethylamino)methyl]-5-methylphenol
InChI:
InChI=1S/C10H14ClNO/c1-7-4-10(13)8(5-9(7)11)6-12(2)3/h4-5,13H,6H2,1-3H3
InChI Key:
GNSYCFOMDQCPCK-UHFFFAOYSA-N
SMILES:
CN(Cc1cc(Cl)c(cc1O)C)C
Properties
Complexity:
163
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
199.076g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
199.678g/mol
Monoisotopic Mass:
199.076g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
23.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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