Home Halogens N-(4-chlorobenzyl)-2-propen-1-amine

N-(4-chlorobenzyl)-2-propen-1-amine

CAS No.:
69957-80-8
Catalog Number:
AG00FBSM
Molecular Formula:
C10H12ClN
Molecular Weight:
181.6620
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Product Description
Catalog Number:
AG00FBSM
Chemical Name:
N-(4-chlorobenzyl)-2-propen-1-amine
CAS Number:
69957-80-8
Molecular Formula:
C10H12ClN
Molecular Weight:
181.6620
MDL Number:
MFCD07406232
IUPAC Name:
N-[(4-chlorophenyl)methyl]prop-2-en-1-amine
InChI:
InChI=1S/C10H12ClN/c1-2-7-12-8-9-3-5-10(11)6-4-9/h2-6,12H,1,7-8H2
InChI Key:
MXLWFBBJEPONGS-UHFFFAOYSA-N
SMILES:
C=CCNCc1ccc(cc1)Cl
Properties
Complexity:
128  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
181.066g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
181.663g/mol
Monoisotopic Mass:
181.066g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Properties