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1881293-85-1 | 1H-Pyrazole, 3-chloro-, hydrochloride (1:1)
CAS No: 1881293-85-1 Catalog No: AG002GPU MDL No:
Product Description
Catalog Number:
AG002GPU
Chemical Name:
1H-Pyrazole, 3-chloro-, hydrochloride (1:1)
CAS Number:
1881293-85-1
Molecular Formula:
C3H4Cl2N2
Molecular Weight:
138.9833
IUPAC Name:
5-chloro-1H-pyrazole;hydrochloride
InChI:
InChI=1S/C3H3ClN2.ClH/c4-3-1-2-5-6-3;/h1-2H,(H,5,6);1H
InChI Key:
UJGQMXHFPXZEAP-UHFFFAOYSA-N
SMILES:
Clc1cc[nH]n1.Cl
Properties
Complexity:
48.1
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
137.975g/mol
Formal Charge:
0
Heavy Atom Count:
7
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
138.979g/mol
Monoisotopic Mass:
137.975g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
28.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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