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1263377-52-1 | 2-Amino-5-bromo-N-isopropylbenzamide
CAS No: 1263377-52-1 Catalog No: AG01FDH4 MDL No:MFCD18089356
Product Description
Catalog Number:
AG01FDH4
Chemical Name:
2-Amino-5-bromo-N-isopropylbenzamide
CAS Number:
1263377-52-1
Molecular Formula:
C10H13BrN2O
Molecular Weight:
257.1270
MDL Number:
MFCD18089356
IUPAC Name:
2-amino-5-bromo-N-propan-2-ylbenzamide
InChI:
InChI=1S/C10H13BrN2O/c1-6(2)13-10(14)8-5-7(11)3-4-9(8)12/h3-6H,12H2,1-2H3,(H,13,14)
InChI Key:
JCBOLMMQLBCXEJ-UHFFFAOYSA-N
SMILES:
CC(NC(=O)c1cc(Br)ccc1N)C
Properties
Complexity:
208
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
256.021g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
257.131g/mol
Monoisotopic Mass:
256.021g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
55.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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