Home Halogens 4-chloro-2-(1H-pyrazol-1-yl)aniline

4-chloro-2-(1H-pyrazol-1-yl)aniline

CAS No.:
947154-37-2
Catalog Number:
AG01B1SZ
Molecular Formula:
C9H8ClN3
Molecular Weight:
193.6329
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Product Description
Catalog Number:
AG01B1SZ
Chemical Name:
4-chloro-2-(1H-pyrazol-1-yl)aniline
CAS Number:
947154-37-2
Molecular Formula:
C9H8ClN3
Molecular Weight:
193.6329
MDL Number:
MFCD20696720
IUPAC Name:
4-chloro-2-pyrazol-1-ylaniline
InChI:
InChI=1S/C9H8ClN3/c10-7-2-3-8(11)9(6-7)13-5-1-4-12-13/h1-6H,11H2
InChI Key:
OTUBGBQBWKWFDT-UHFFFAOYSA-N
SMILES:
Clc1ccc(c(c1)n1cccn1)N
Properties
Complexity:
176  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
193.041g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
193.634g/mol
Monoisotopic Mass:
193.041g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
43.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Properties