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Home > Bromides > 1142194-39-5
1142194-39-5 | 2-Pyrrolidinone, 1-(4-bromo-2-pyridinyl)-
CAS No: 1142194-39-5 Catalog No: AG000AUG MDL No:MFCD11869625
Product Description
Catalog Number:
AG000AUG
Chemical Name:
2-Pyrrolidinone, 1-(4-bromo-2-pyridinyl)-
CAS Number:
1142194-39-5
Molecular Formula:
C9H9BrN2O
Molecular Weight:
241.0846
MDL Number:
MFCD11869625
IUPAC Name:
1-(4-bromopyridin-2-yl)pyrrolidin-2-one
InChI:
InChI=1S/C9H9BrN2O/c10-7-3-4-11-8(6-7)12-5-1-2-9(12)13/h3-4,6H,1-2,5H2
InChI Key:
UVFXYTSNRWHLCC-UHFFFAOYSA-N
SMILES:
Brc1ccnc(c1)N1CCCC1=O
Properties
Complexity:
210
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
239.99g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
241.088g/mol
Monoisotopic Mass:
239.99g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
33.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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