Home Carboxys methyl 3-(benzylamino)oxolane-3-carboxylate hydrochloride

methyl 3-(benzylamino)oxolane-3-carboxylate hydrochloride

CAS No.:
1803610-75-4
Catalog Number:
AG01B7YP
Molecular Formula:
C13H18ClNO3
Molecular Weight:
271.7399
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Product Description
Catalog Number:
AG01B7YP
Chemical Name:
methyl 3-(benzylamino)oxolane-3-carboxylate hydrochloride
CAS Number:
1803610-75-4
Molecular Formula:
C13H18ClNO3
Molecular Weight:
271.7399
MDL Number:
MFCD28145567
IUPAC Name:
methyl 3-(benzylamino)oxolane-3-carboxylate;hydrochloride
InChI:
InChI=1S/C13H17NO3.ClH/c1-16-12(15)13(7-8-17-10-13)14-9-11-5-3-2-4-6-11;/h2-6,14H,7-10H2,1H3;1H
InChI Key:
ONVFSLFDLSXIHK-UHFFFAOYSA-N
SMILES:
COC(=O)C1(COCC1)NCc1ccccc1.Cl
Properties
Complexity:
263  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
271.098g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
271.741g/mol
Monoisotopic Mass:
271.098g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
47.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties