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13726-14-2 | Benzenamine, 4-chloro-3-methoxy-
CAS No: 13726-14-2 Catalog No: AG00130R MDL No:MFCD00672967
Product Description
Catalog Number:
AG00130R
Chemical Name:
Benzenamine, 4-chloro-3-methoxy-
CAS Number:
13726-14-2
Molecular Formula:
C7H8ClNO
Molecular Weight:
157.5975
MDL Number:
MFCD00672967
IUPAC Name:
4-chloro-3-methoxyaniline
InChI:
InChI=1S/C7H8ClNO/c1-10-7-4-5(9)2-3-6(7)8/h2-4H,9H2,1H3
InChI Key:
LNKBDFVSILQKSI-UHFFFAOYSA-N
SMILES:
COc1cc(N)ccc1Cl
Properties
Complexity:
110
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
157.029g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
157.597g/mol
Monoisotopic Mass:
157.029g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
35.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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