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Home > Nitro Compounds > 69552-16-5
69552-16-5 | 2-Methyl-1-(p-nitrophenethyl)-3-phenylpyrrolidin-3-ol propionate
CAS No: 69552-16-5 Catalog No: AG00G144 MDL No:
Product Description
Catalog Number:
AG00G144
Chemical Name:
2-Methyl-1-(p-nitrophenethyl)-3-phenylpyrrolidin-3-ol propionate
CAS Number:
69552-16-5
IUPAC Name:
[2-methyl-1-[2-(4-nitrophenyl)ethyl]-3-phenylpyrrolidin-3-yl] propanoate
InChI:
InChI=1S/C22H26N2O4/c1-3-21(25)28-22(19-7-5-4-6-8-19)14-16-23(17(22)2)15-13-18-9-11-20(12-10-18)24(26)27/h4-12,17H,3,13-16H2,1-2H3
InChI Key:
CMISDVAKYMECGW-UHFFFAOYSA-N
Properties
Complexity:
535
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
382.189g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
382.46g/mol
Monoisotopic Mass:
382.189g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
75.4A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3
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