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1240564-34-4 | 1-(1-phenylethyl)-1H-pyrazol-3-amine
CAS No: 1240564-34-4 Catalog No: AG00JV31 MDL No:MFCD16810829
Product Description
Catalog Number:
AG00JV31
Chemical Name:
1-(1-phenylethyl)-1H-pyrazol-3-amine
CAS Number:
1240564-34-4
Molecular Formula:
C11H13N3
Molecular Weight:
187.2410
MDL Number:
MFCD16810829
IUPAC Name:
1-(1-phenylethyl)pyrazol-3-amine
InChI:
InChI=1S/C11H13N3/c1-9(10-5-3-2-4-6-10)14-8-7-11(12)13-14/h2-9H,1H3,(H2,12,13)
InChI Key:
ILDNOUIMSQWSKB-UHFFFAOYSA-N
SMILES:
Nc1ccn(n1)C(c1ccccc1)C
Properties
Complexity:
177
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
187.111g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
187.246g/mol
Monoisotopic Mass:
187.111g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
43.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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