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Home > Nitro Compounds > 1029432-34-5
1029432-34-5 | (R)-tert-Butyl 1-(2-nitrophenyl)pyrrolidine-3-ylcarbamate
CAS No: 1029432-34-5 Catalog No: AG01EQME MDL No:
Product Description
Catalog Number:
AG01EQME
Chemical Name:
(R)-tert-Butyl 1-(2-nitrophenyl)pyrrolidine-3-ylcarbamate
CAS Number:
1029432-34-5
Molecular Formula:
C15H21N3O4
Molecular Weight:
307.3449
IUPAC Name:
tert-butyl N-[(3R)-1-(2-nitrophenyl)pyrrolidin-3-yl]carbamate
InChI:
InChI=1S/C15H21N3O4/c1-15(2,3)22-14(19)16-11-8-9-17(10-11)12-6-4-5-7-13(12)18(20)21/h4-7,11H,8-10H2,1-3H3,(H,16,19)/t11-/m1/s1
InChI Key:
ASGSCQCZBVODJB-LLVKDONJSA-N
SMILES:
O=C(OC(C)(C)C)N[C@@H]1CCN(C1)c1ccccc1[N+](=O)[O-]
Properties
Complexity:
416
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
307.153g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
307.35g/mol
Monoisotopic Mass:
307.153g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
87.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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