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102170-53-6 | Benzenamine, 4-bromo-5-chloro-2-methoxy-
CAS No: 102170-53-6 Catalog No: AG0006TD MDL No:MFCD09878150
Product Description
Catalog Number:
AG0006TD
Chemical Name:
Benzenamine, 4-bromo-5-chloro-2-methoxy-
CAS Number:
102170-53-6
Molecular Formula:
C7H7BrClNO
Molecular Weight:
236.4936
MDL Number:
MFCD09878150
IUPAC Name:
4-bromo-5-chloro-2-methoxyaniline
InChI:
InChI=1S/C7H7BrClNO/c1-11-7-2-4(8)5(9)3-6(7)10/h2-3H,10H2,1H3
InChI Key:
QXHFCTQXBMGLQY-UHFFFAOYSA-N
SMILES:
COc1cc(Br)c(cc1N)Cl
Properties
Complexity:
136
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.94g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
236.493g/mol
Monoisotopic Mass:
234.94g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
35.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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