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132026-22-3 | 1H-Pyrazole-1-ethanol, 4,5-diamino-3-methyl-
CAS No: 132026-22-3 Catalog No: AG00102K MDL No:
Product Description
Catalog Number:
AG00102K
Chemical Name:
1H-Pyrazole-1-ethanol, 4,5-diamino-3-methyl-
CAS Number:
132026-22-3
Molecular Formula:
C6H12N4O
Molecular Weight:
156.1857
IUPAC Name:
2-(4,5-diamino-3-methylpyrazol-1-yl)ethanol
InChI:
InChI=1S/C6H12N4O/c1-4-5(7)6(8)10(9-4)2-3-11/h11H,2-3,7-8H2,1H3
InChI Key:
QBOQGVXXIUOJRM-UHFFFAOYSA-N
SMILES:
OCCn1nc(c(c1N)N)C
Properties
Complexity:
132
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
156.101g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
156.189g/mol
Monoisotopic Mass:
156.101g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
90.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.1
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