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1252761-56-0 | 2-Pyrrolidinone, 4-(3,4-dichlorophenyl)-, (4R)-
CAS No: 1252761-56-0 Catalog No: AG000NF9 MDL No:
Product Description
Catalog Number:
AG000NF9
Chemical Name:
2-Pyrrolidinone, 4-(3,4-dichlorophenyl)-, (4R)-
CAS Number:
1252761-56-0
Molecular Formula:
C10H9Cl2NO
Molecular Weight:
230.0906
IUPAC Name:
(4R)-4-(3,4-dichlorophenyl)pyrrolidin-2-one
InChI:
InChI=1S/C10H9Cl2NO/c11-8-2-1-6(3-9(8)12)7-4-10(14)13-5-7/h1-3,7H,4-5H2,(H,13,14)/t7-/m0/s1
InChI Key:
QZRJFUBGLZHBHU-ZETCQYMHSA-N
SMILES:
O=C1NC[C@H](C1)c1ccc(c(c1)Cl)Cl
Properties
Complexity:
234
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
229.006g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
230.088g/mol
Monoisotopic Mass:
229.006g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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