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1439921-98-8 | (S)-5-(4-NITROPHENYL)-2-(PYRROLIDIN-2-YL)-1H-IMIDAZOLE 2HCL
CAS No: 1439921-98-8 Catalog No: AG01DX2M MDL No:
Product Description
Catalog Number:
AG01DX2M
Chemical Name:
(S)-5-(4-NITROPHENYL)-2-(PYRROLIDIN-2-YL)-1H-IMIDAZOLE 2HCL
CAS Number:
1439921-98-8
IUPAC Name:
5-(4-nitrophenyl)-2-[(2S)-pyrrolidin-2-yl]-1H-imidazole;dihydrochloride
InChI:
InChI=1S/C13H14N4O2.2ClH/c18-17(19)10-5-3-9(4-6-10)12-8-15-13(16-12)11-2-1-7-14-11;;/h3-6,8,11,14H,1-2,7H2,(H,15,16);2*1H/t11-;;/m0../s1
InChI Key:
GYJZUKVXUVLWOM-IDMXKUIJSA-N
Properties
Complexity:
325
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
330.065g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
331.197g/mol
Monoisotopic Mass:
330.065g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
86.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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