Home Other Building Blocks 3-(4-Butoxyphenyl)-beta-alanine

3-(4-Butoxyphenyl)-beta-alanine

CAS No.:
405294-73-7
Catalog Number:
AG00BYLS
Molecular Formula:
C13H19NO3
Molecular Weight:
237.2949
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
25mg
98%
In Stock USA
United States
$61
- +
100mg
98%
In Stock USA
United States
$123
- +
250mg
98%
In Stock USA
United States
$226
- +
1g
98%
In Stock USA
United States
$433
- +
5g
98%
In Stock USA
United States
$1261
- +
Product Description
Catalog Number:
AG00BYLS
Chemical Name:
3-(4-Butoxyphenyl)-beta-alanine
CAS Number:
405294-73-7
Molecular Formula:
C13H19NO3
Molecular Weight:
237.2949
MDL Number:
MFCD00749506
IUPAC Name:
3-amino-3-(4-butoxyphenyl)propanoic acid
InChI:
InChI=1S/C13H19NO3/c1-2-3-8-17-11-6-4-10(5-7-11)12(14)9-13(15)16/h4-7,12H,2-3,8-9,14H2,1H3,(H,15,16)
InChI Key:
MBSPCPOKMWFVAG-UHFFFAOYSA-N
SMILES:
CCCCOc1ccc(cc1)C(CC(=O)O)N
Properties
Complexity:
225  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
237.136g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
237.299g/mol
Monoisotopic Mass:
237.136g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
72.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.7  
Properties