Home Other Building Blocks N-Isobutyl 3-fluorobenzylamine

N-Isobutyl 3-fluorobenzylamine

CAS No.:
1019578-68-7
Catalog Number:
AG00062X
Molecular Formula:
C11H16FN
Molecular Weight:
181.2498
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$150
- +
5g
98%
In Stock USA
United States
$450
- +
10g
98%
In Stock USA
United States
$738
- +
Product Description
Catalog Number:
AG00062X
Chemical Name:
N-Isobutyl 3-fluorobenzylamine
CAS Number:
1019578-68-7
Molecular Formula:
C11H16FN
Molecular Weight:
181.2498
MDL Number:
MFCD11139645
IUPAC Name:
N-[(3-fluorophenyl)methyl]-2-methylpropan-1-amine
InChI:
InChI=1S/C11H16FN/c1-9(2)7-13-8-10-4-3-5-11(12)6-10/h3-6,9,13H,7-8H2,1-2H3
InChI Key:
HCNBCVDBTLLOSB-UHFFFAOYSA-N
SMILES:
CC(CNCc1cccc(c1)F)C
Properties
Complexity:
136  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
181.127g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
181.254g/mol
Monoisotopic Mass:
181.127g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  
Properties