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70875-36-4 | Propanamide, 3-bromo-N-(2-phenylethyl)-
CAS No: 70875-36-4 Catalog No: AG005FP2 MDL No:
Product Description
Catalog Number:
AG005FP2
Chemical Name:
Propanamide, 3-bromo-N-(2-phenylethyl)-
CAS Number:
70875-36-4
Molecular Formula:
C11H14BrNO
Molecular Weight:
256.1390
IUPAC Name:
3-bromo-N-(2-phenylethyl)propanamide
InChI:
InChI=1S/C11H14BrNO/c12-8-6-11(14)13-9-7-10-4-2-1-3-5-10/h1-5H,6-9H2,(H,13,14)
InChI Key:
FFKVICLQFKSENZ-UHFFFAOYSA-N
SMILES:
BrCCC(=O)NCCc1ccccc1
Properties
Complexity:
167
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
255.026g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
256.143g/mol
Monoisotopic Mass:
255.026g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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