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Home > Bromides > 1177237-98-7
1177237-98-7 | N-(3-Bromo-benzyl)-2-chloro-N-isopropyl-acetamide
CAS No: 1177237-98-7 Catalog No: AG01F96H MDL No:
Product Description
Catalog Number:
AG01F96H
Chemical Name:
N-(3-Bromo-benzyl)-2-chloro-N-isopropyl-acetamide
CAS Number:
1177237-98-7
Molecular Formula:
C12H15BrClNO
Molecular Weight:
304.6106
IUPAC Name:
N-[(3-bromophenyl)methyl]-2-chloro-N-propan-2-ylacetamide
InChI:
InChI=1S/C12H15BrClNO/c1-9(2)15(12(16)7-14)8-10-4-3-5-11(13)6-10/h3-6,9H,7-8H2,1-2H3
InChI Key:
SXKVHKSPXXVHGG-UHFFFAOYSA-N
SMILES:
ClCC(=O)N(C(C)C)Cc1cccc(c1)Br
Properties
Complexity:
235
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
303.003g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
304.612g/mol
Monoisotopic Mass:
303.003g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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