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Home > Nitro Compounds > 85922-30-1
85922-30-1 | Benzamide, N-[(1R)-1-(1-naphthalenyl)ethyl]-3,5-dinitro-
CAS No: 85922-30-1 Catalog No: AG004MSZ MDL No:
Product Description
Catalog Number:
AG004MSZ
Chemical Name:
Benzamide, N-[(1R)-1-(1-naphthalenyl)ethyl]-3,5-dinitro-
CAS Number:
85922-30-1
Molecular Formula:
C19H15N3O5
Molecular Weight:
365.3395
IUPAC Name:
N-[(1R)-1-naphthalen-1-ylethyl]-3,5-dinitrobenzamide
InChI:
InChI=1S/C19H15N3O5/c1-12(17-8-4-6-13-5-2-3-7-18(13)17)20-19(23)14-9-15(21(24)25)11-16(10-14)22(26)27/h2-12H,1H3,(H,20,23)/t12-/m1/s1
InChI Key:
RUUPGHVIODHXRI-GFCCVEGCSA-N
SMILES:
C[C@H](c1cccc2c1cccc2)NC(=O)c1cc(cc(c1)[N+](=O)[O-])[N+](=O)[O-]
Properties
Complexity:
551
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
365.101g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
365.345g/mol
Monoisotopic Mass:
365.101g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
121A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4
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