Home Carboxys 3-{[(benzyloxy)carbonyl]amino}oxolane-3-carboxylic acid

3-{[(benzyloxy)carbonyl]amino}oxolane-3-carboxylic acid

CAS No.:
1262406-85-8
Catalog Number:
AG00HRFC
Molecular Formula:
C13H15NO5
Molecular Weight:
265.2619
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Product Description
Catalog Number:
AG00HRFC
Chemical Name:
3-{[(benzyloxy)carbonyl]amino}oxolane-3-carboxylic acid
CAS Number:
1262406-85-8
Molecular Formula:
C13H15NO5
Molecular Weight:
265.2619
MDL Number:
MFCD18375005
IUPAC Name:
3-(phenylmethoxycarbonylamino)oxolane-3-carboxylic acid
InChI:
InChI=1S/C13H15NO5/c15-11(16)13(6-7-18-9-13)14-12(17)19-8-10-4-2-1-3-5-10/h1-5H,6-9H2,(H,14,17)(H,15,16)
InChI Key:
HDPOINUGZWATFQ-UHFFFAOYSA-N
SMILES:
O=C(NC1(COCC1)C(=O)O)OCc1ccccc1
Properties
Complexity:
340  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
265.095g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
265.265g/mol
Monoisotopic Mass:
265.095g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
84.9A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Properties