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1261795-06-5 | 4-Amino-2-methylbenzyl bromide
CAS No: 1261795-06-5 Catalog No: AG01FF0P MDL No:
Product Description
Catalog Number:
AG01FF0P
Chemical Name:
4-Amino-2-methylbenzyl bromide
CAS Number:
1261795-06-5
Molecular Formula:
C8H10BrN
Molecular Weight:
200.0757
IUPAC Name:
4-(bromomethyl)-3-methylaniline
InChI:
InChI=1S/C8H10BrN/c1-6-4-8(10)3-2-7(6)5-9/h2-4H,5,10H2,1H3
InChI Key:
NSMQMQBKZBNYCB-UHFFFAOYSA-N
SMILES:
BrCc1ccc(cc1C)N
Properties
Complexity:
105
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
199g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
200.079g/mol
Monoisotopic Mass:
199g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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