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Home > Nitro Compounds > 863401-75-6
863401-75-6 | Carbamic acid, methyl[1-(4-nitrophenyl)-3-pyrrolidinyl]-,1,1-dimethylethyl ester
CAS No: 863401-75-6 Catalog No: AG00IE0P MDL No:
Product Description
Catalog Number:
AG00IE0P
Chemical Name:
Carbamic acid, methyl[1-(4-nitrophenyl)-3-pyrrolidinyl]-,1,1-dimethylethyl ester
CAS Number:
863401-75-6
IUPAC Name:
tert-butyl N-methyl-N-[1-(4-nitrophenyl)pyrrolidin-3-yl]carbamate
InChI:
InChI=1S/C16H23N3O4/c1-16(2,3)23-15(20)17(4)14-9-10-18(11-14)12-5-7-13(8-6-12)19(21)22/h5-8,14H,9-11H2,1-4H3
InChI Key:
MQOJFWUJXJPYDP-UHFFFAOYSA-N
Properties
Complexity:
436
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
321.169g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
321.377g/mol
Monoisotopic Mass:
321.169g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
78.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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