Home Carbonyls (2S)-2-amino-4-{[(benzyloxy)carbonyl]amino}butanoic acid

(2S)-2-amino-4-{[(benzyloxy)carbonyl]amino}butanoic acid

CAS No.:
2130-77-0
Catalog Number:
AG00C4MK
Molecular Formula:
C12H16N2O4
Molecular Weight:
252.2664
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
≥ 97% (NMR)
1 week
United States
$199
- +
1g
≥ 97% (NMR)
1 week
United States
$345
- +
5g
≥ 97% (NMR)
1 week
United States
$1493
- +
Product Description
Catalog Number:
AG00C4MK
Chemical Name:
(2S)-2-amino-4-{[(benzyloxy)carbonyl]amino}butanoic acid
CAS Number:
2130-77-0
Molecular Formula:
C12H16N2O4
Molecular Weight:
252.2664
MDL Number:
MFCD08275863
IUPAC Name:
(2S)-2-amino-4-(phenylmethoxycarbonylamino)butanoic acid
InChI:
InChI=1S/C12H16N2O4/c13-10(11(15)16)6-7-14-12(17)18-8-9-4-2-1-3-5-9/h1-5,10H,6-8,13H2,(H,14,17)(H,15,16)/t10-/m0/s1
InChI Key:
SDFDIECLEXOBAG-JTQLQIEISA-N
SMILES:
O=C(OCc1ccccc1)NCC[C@@H](C(=O)O)N
Properties
Complexity:
277  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
252.111g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
252.27g/mol
Monoisotopic Mass:
252.111g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
102A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.8  
Properties