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1226808-56-5 | 2H-Indazole, 4,5,6,7-tetrahydro-5-methyl-, hydrochloride (1:1)
CAS No: 1226808-56-5 Catalog No: AG0017M9 MDL No:MFCD16295092
Product Description
Catalog Number:
AG0017M9
Chemical Name:
2H-Indazole, 4,5,6,7-tetrahydro-5-methyl-, hydrochloride (1:1)
CAS Number:
1226808-56-5
Molecular Formula:
C8H13ClN2
Molecular Weight:
172.6552
MDL Number:
MFCD16295092
IUPAC Name:
5-methyl-4,5,6,7-tetrahydro-1H-indazole;hydrochloride
InChI:
InChI=1S/C8H12N2.ClH/c1-6-2-3-8-7(4-6)5-9-10-8;/h5-6H,2-4H2,1H3,(H,9,10);1H
InChI Key:
XIBRZYYINCBWLL-UHFFFAOYSA-N
SMILES:
CC1CCc2c(C1)c[nH]n2.Cl
Properties
Complexity:
124
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
172.077g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
172.656g/mol
Monoisotopic Mass:
172.077g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
28.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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