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951884-15-4 | 2-Bromo-5-fluoro-N,N-diisopropylbenzamide
CAS No: 951884-15-4 Catalog No: AG003SFW MDL No:MFCD09800912
Product Description
Catalog Number:
AG003SFW
Chemical Name:
2-Bromo-5-fluoro-N,N-diisopropylbenzamide
CAS Number:
951884-15-4
Molecular Formula:
C13H17BrFNO
Molecular Weight:
302.1826
MDL Number:
MFCD09800912
IUPAC Name:
2-bromo-5-fluoro-N,N-di(propan-2-yl)benzamide
InChI:
InChI=1S/C13H17BrFNO/c1-8(2)16(9(3)4)13(17)11-7-10(15)5-6-12(11)14/h5-9H,1-4H3
InChI Key:
XQHRWTNPRMQUQX-UHFFFAOYSA-N
SMILES:
CC(N(C(=O)c1cc(F)ccc1Br)C(C)C)C
Properties
Complexity:
262
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
301.048g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
302.187g/mol
Monoisotopic Mass:
301.048g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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