Home Other Building Blocks 4-[(4-methyl-1H-pyrazol-1-yl)methyl]aniline

4-[(4-methyl-1H-pyrazol-1-yl)methyl]aniline

CAS No.:
1183309-99-0
Catalog Number:
AG01AH4X
Molecular Formula:
C11H13N3
Molecular Weight:
187.2410
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Product Description
Catalog Number:
AG01AH4X
Chemical Name:
4-[(4-methyl-1H-pyrazol-1-yl)methyl]aniline
CAS Number:
1183309-99-0
Molecular Formula:
C11H13N3
Molecular Weight:
187.2410
MDL Number:
MFCD12763842
IUPAC Name:
4-[(4-methylpyrazol-1-yl)methyl]aniline
InChI:
InChI=1S/C11H13N3/c1-9-6-13-14(7-9)8-10-2-4-11(12)5-3-10/h2-7H,8,12H2,1H3
InChI Key:
QWPPDCVKEZUYQW-UHFFFAOYSA-N
SMILES:
Nc1ccc(cc1)Cn1ncc(c1)C
Properties
Complexity:
175  
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:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties