sales@angenesci.com
Login | Register
logo
Structures Search
Home Other Building Blocks 3-(4-Chlorophenyl)propan-1-amine

3-(4-Chlorophenyl)propan-1-amine

CAS No.:
18655-50-0
Catalog Number:
AG0037WL
Molecular Formula:
C9H12ClN
Molecular Weight:
169.6513
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
In Stock USA
United States
$100
- +
1g
95%
In Stock USA
United States
$250
- +
5g
95%
In Stock USA
United States
$750
- +
Product Description
Catalog Number:
AG0037WL
Chemical Name:
3-(4-Chlorophenyl)propan-1-amine
CAS Number:
18655-50-0
Molecular Formula:
C9H12ClN
Molecular Weight:
169.6513
MDL Number:
MFCD06212968
IUPAC Name:
3-(4-chlorophenyl)propan-1-amine
InChI:
InChI=1S/C9H12ClN/c10-9-5-3-8(4-6-9)2-1-7-11/h3-6H,1-2,7,11H2
InChI Key:
RVLNDSYSQLMPRC-UHFFFAOYSA-N
SMILES:
NCCCc1ccc(cc1)Cl
Properties
Complexity:
97.7  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
169.066g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
169.652g/mol
Monoisotopic Mass:
169.066g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Literature
Title Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. Bioorganic & medicinal chemistry letters 20101101
Properties