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133088-44-5 | Benzenamine, 2-chloro-5-methoxy-4-methyl-
CAS No: 133088-44-5 Catalog No: AG00148N MDL No:
Product Description
Catalog Number:
AG00148N
Chemical Name:
Benzenamine, 2-chloro-5-methoxy-4-methyl-
CAS Number:
133088-44-5
Molecular Formula:
C8H10ClNO
Molecular Weight:
171.6241
IUPAC Name:
2-chloro-5-methoxy-4-methylaniline
InChI:
InChI=1S/C8H10ClNO/c1-5-3-6(9)7(10)4-8(5)11-2/h3-4H,10H2,1-2H3
InChI Key:
KBJTUEYTPBMKAM-UHFFFAOYSA-N
SMILES:
COc1cc(N)c(cc1C)Cl
Properties
Complexity:
131
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
171.045g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
171.624g/mol
Monoisotopic Mass:
171.045g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
35.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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