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14088-96-1 | 2-Imidazolidinone, 1-(3-bromophenyl)-
CAS No: 14088-96-1 Catalog No: AG001CZ2 MDL No:MFCD08443974
Product Description
Catalog Number:
AG001CZ2
Chemical Name:
2-Imidazolidinone, 1-(3-bromophenyl)-
CAS Number:
14088-96-1
Molecular Formula:
C9H9BrN2O
Molecular Weight:
241.0846
MDL Number:
MFCD08443974
IUPAC Name:
1-(3-bromophenyl)imidazolidin-2-one
InChI:
InChI=1S/C9H9BrN2O/c10-7-2-1-3-8(6-7)12-5-4-11-9(12)13/h1-3,6H,4-5H2,(H,11,13)
InChI Key:
YWUYVOVMNCGEQZ-UHFFFAOYSA-N
SMILES:
Brc1cccc(c1)N1CCNC1=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:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
241.088g/mol
Monoisotopic Mass:
239.99g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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