Home Other Building Blocks 1H-Pyrazole-4-methanamine, 1-(3-methoxyphenyl)-

1H-Pyrazole-4-methanamine, 1-(3-methoxyphenyl)-

CAS No.:
1015845-54-1
Catalog Number:
AG0004UA
Molecular Formula:
C11H13N3O
Molecular Weight:
203.2404
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$64
- +
5g
95%
In Stock USA
United States
$125
- +
Product Description
Catalog Number:
AG0004UA
Chemical Name:
1H-Pyrazole-4-methanamine, 1-(3-methoxyphenyl)-
CAS Number:
1015845-54-1
Molecular Formula:
C11H13N3O
Molecular Weight:
203.2404
MDL Number:
MFCD08059756
IUPAC Name:
[1-(3-methoxyphenyl)pyrazol-4-yl]methanamine
InChI:
InChI=1S/C11H13N3O/c1-15-11-4-2-3-10(5-11)14-8-9(6-12)7-13-14/h2-5,7-8H,6,12H2,1H3
InChI Key:
KQJJFDIEMLIASM-UHFFFAOYSA-N
SMILES:
COc1cccc(c1)n1ncc(c1)CN
Properties
Complexity:
200  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
203.106g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
203.245g/mol
Monoisotopic Mass:
203.106g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
53.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7  
Properties