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1150271-18-3 | Benzenamine, 2-bromo-N,N-diethyl-4-nitro-
CAS No: 1150271-18-3 Catalog No: AG000FP7 MDL No:MFCD12026041
Product Description
Catalog Number:
AG000FP7
Chemical Name:
Benzenamine, 2-bromo-N,N-diethyl-4-nitro-
CAS Number:
1150271-18-3
Molecular Formula:
C10H13BrN2O2
Molecular Weight:
273.1264
MDL Number:
MFCD12026041
IUPAC Name:
2-bromo-N,N-diethyl-4-nitroaniline
InChI:
InChI=1S/C10H13BrN2O2/c1-3-12(4-2)10-6-5-8(13(14)15)7-9(10)11/h5-7H,3-4H2,1-2H3
InChI Key:
PCXIHLGUPLRWQI-UHFFFAOYSA-N
SMILES:
CCN(c1ccc(cc1Br)[N+](=O)[O-])CC
Properties
Complexity:
216
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
272.016g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
273.13g/mol
Monoisotopic Mass:
272.016g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
49.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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