Home Other Building Blocks 3-Benzylaniline

3-Benzylaniline

CAS No.:
61424-26-8
Catalog Number:
AG003IYN
Molecular Formula:
C13H13N
Molecular Weight:
183.2490
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$229
- +
Product Description
Catalog Number:
AG003IYN
Chemical Name:
3-Benzylaniline
CAS Number:
61424-26-8
Molecular Formula:
C13H13N
Molecular Weight:
183.2490
MDL Number:
MFCD01310782
IUPAC Name:
3-benzylaniline
InChI:
InChI=1S/C13H13N/c14-13-8-4-7-12(10-13)9-11-5-2-1-3-6-11/h1-8,10H,9,14H2
InChI Key:
GZYMMTQDXHJALZ-UHFFFAOYSA-N
SMILES:
Nc1cccc(c1)Cc1ccccc1
NSC Number:
210972
Properties
Complexity:
161  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
183.105g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
183.254g/mol
Monoisotopic Mass:
183.105g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  
Properties