200,000+ products from a single source!
sales@angenechem.com
Home > Carboxes > 1363166-19-1
1363166-19-1 | 1,3-Piperidinedicarboxylic acid, 3-(2-propen-1-yl)-, 3-methyl 1-(phenylmethyl) ester
CAS No: 1363166-19-1 Catalog No: AG0011MQ MDL No:MFCD21641323
Product Description
Catalog Number:
AG0011MQ
Chemical Name:
1,3-Piperidinedicarboxylic acid, 3-(2-propen-1-yl)-, 3-methyl 1-(phenylmethyl) ester
CAS Number:
1363166-19-1
Molecular Formula:
C18H23NO4
Molecular Weight:
317.3795
MDL Number:
MFCD21641323
IUPAC Name:
1-O-benzyl 3-O-methyl 3-prop-2-enylpiperidine-1,3-dicarboxylate
InChI:
InChI=1S/C18H23NO4/c1-3-10-18(16(20)22-2)11-7-12-19(14-18)17(21)23-13-15-8-5-4-6-9-15/h3-6,8-9H,1,7,10-14H2,2H3
InChI Key:
VMKUXWYEQITSOE-UHFFFAOYSA-N
SMILES:
C=CCC1(CCCN(C1)C(=O)OCc1ccccc1)C(=O)OC
Properties
Complexity:
431
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
317.163g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
317.385g/mol
Monoisotopic Mass:
317.163g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
55.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.