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1363380-51-1 | Pyrazolo[1,5-a]pyrimidine, 5-chloro-3-nitro-
CAS No: 1363380-51-1 Catalog No: AG0011NW MDL No:MFCD22415211
Product Description
Catalog Number:
AG0011NW
Chemical Name:
Pyrazolo[1,5-a]pyrimidine, 5-chloro-3-nitro-
CAS Number:
1363380-51-1
Molecular Formula:
C6H3ClN4O2
Molecular Weight:
198.5666
MDL Number:
MFCD22415211
IUPAC Name:
5-chloro-3-nitropyrazolo[1,5-a]pyrimidine
InChI:
InChI=1S/C6H3ClN4O2/c7-5-1-2-10-6(9-5)4(3-8-10)11(12)13/h1-3H
InChI Key:
VYEUPRYCLWAOMU-UHFFFAOYSA-N
SMILES:
Clc1ccn2c(n1)c(cn2)[N+](=O)[O-]
Properties
Complexity:
221
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
197.994g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
198.566g/mol
Monoisotopic Mass:
197.994g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
76A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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