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1389264-31-6 | Pyrrolo[3,4-c]pyrazole, 1,4,5,6-tetrahydro-3-methyl-, hydrochloride (1:1)
CAS No: 1389264-31-6 Catalog No: AG0019V9 MDL No:MFCD27986896
Product Description
Catalog Number:
AG0019V9
Chemical Name:
Pyrrolo[3,4-c]pyrazole, 1,4,5,6-tetrahydro-3-methyl-, hydrochloride (1:1)
CAS Number:
1389264-31-6
Molecular Formula:
C6H10ClN3
Molecular Weight:
159.6167
MDL Number:
MFCD27986896
IUPAC Name:
3-methyl-2,4,5,6-tetrahydropyrrolo[3,4-c]pyrazole;hydrochloride
InChI:
InChI=1S/C6H9N3.ClH/c1-4-5-2-7-3-6(5)9-8-4;/h7H,2-3H2,1H3,(H,8,9);1H
InChI Key:
JYYAGGWXWLOABC-UHFFFAOYSA-N
SMILES:
Cc1[nH]nc2c1CNC2.Cl
Properties
Complexity:
115
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
159.056g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
159.617g/mol
Monoisotopic Mass:
159.056g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
40.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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