Home Carboxys 3-Oxazolidinecarboxylic acid, 4-(hydroxymethyl)-2,2-dimethyl-,phenylmethyl ester, (4S)-

3-Oxazolidinecarboxylic acid, 4-(hydroxymethyl)-2,2-dimethyl-,phenylmethyl ester, (4S)-

CAS No.:
133464-36-5
Catalog Number:
AG00HSXU
Molecular Formula:
C14H19NO4
Molecular Weight:
265.3050
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Product Description
Catalog Number:
AG00HSXU
Chemical Name:
3-Oxazolidinecarboxylic acid, 4-(hydroxymethyl)-2,2-dimethyl-,phenylmethyl ester, (4S)-
CAS Number:
133464-36-5
Molecular Formula:
C14H19NO4
Molecular Weight:
265.3050
MDL Number:
MFCD16620549
IUPAC Name:
benzyl (4S)-4-(hydroxymethyl)-2,2-dimethyl-1,3-oxazolidine-3-carboxylate
InChI:
InChI=1S/C14H19NO4/c1-14(2)15(12(8-16)10-19-14)13(17)18-9-11-6-4-3-5-7-11/h3-7,12,16H,8-10H2,1-2H3/t12-/m0/s1
InChI Key:
APDPVSVYWSMCJA-LBPRGKRZSA-N
SMILES:
OC[C@H]1COC(N1C(=O)OCc1ccccc1)(C)C
Properties
Complexity:
313  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
265.131g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
265.309g/mol
Monoisotopic Mass:
265.131g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
59A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Properties