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10126-37-1 | Benzenemethanamine, 2-bromo-5-methoxy-N,N-dimethyl-
CAS No: 10126-37-1 Catalog No: AG00043G MDL No:MFCD06657799
Product Description
Catalog Number:
AG00043G
Chemical Name:
Benzenemethanamine, 2-bromo-5-methoxy-N,N-dimethyl-
CAS Number:
10126-37-1
Molecular Formula:
C10H14BrNO
Molecular Weight:
244.1283
MDL Number:
MFCD06657799
IUPAC Name:
1-(2-bromo-5-methoxyphenyl)-N,N-dimethylmethanamine
InChI:
InChI=1S/C10H14BrNO/c1-12(2)7-8-6-9(13-3)4-5-10(8)11/h4-6H,7H2,1-3H3
InChI Key:
KMYPJJLCQWNEKN-UHFFFAOYSA-N
SMILES:
COc1ccc(c(c1)CN(C)C)Br
Properties
Complexity:
152
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
243.026g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
244.132g/mol
Monoisotopic Mass:
243.026g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
12.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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