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117018-99-2 | 2-Pyrrolidinone, 1-(2-bromoethyl)-
CAS No: 117018-99-2 Catalog No: AG000DKN MDL No:MFCD09804536
Product Description
Catalog Number:
AG000DKN
Chemical Name:
2-Pyrrolidinone, 1-(2-bromoethyl)-
CAS Number:
117018-99-2
Molecular Formula:
C6H10BrNO
Molecular Weight:
192.0537
MDL Number:
MFCD09804536
IUPAC Name:
1-(2-bromoethyl)pyrrolidin-2-one
InChI:
InChI=1S/C6H10BrNO/c7-3-5-8-4-1-2-6(8)9/h1-5H2
InChI Key:
BVAQGSLQZNUFHQ-UHFFFAOYSA-N
SMILES:
BrCCN1CCCC1=O
Properties
Complexity:
116
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
190.995g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
192.056g/mol
Monoisotopic Mass:
190.995g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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