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4867-79-2 | 4-Pyridinecarbamic acid 3,4,5-trimethoxybenzyl ester
CAS No: 4867-79-2 Catalog No: AG00E03I MDL No:
Product Description
Catalog Number:
AG00E03I
Chemical Name:
4-Pyridinecarbamic acid 3,4,5-trimethoxybenzyl ester
CAS Number:
4867-79-2
IUPAC Name:
(3,4,5-trimethoxyphenyl)methyl N-pyridin-4-ylcarbamate
InChI:
InChI=1S/C16H18N2O5/c1-20-13-8-11(9-14(21-2)15(13)22-3)10-23-16(19)18-12-4-6-17-7-5-12/h4-9H,10H2,1-3H3,(H,17,18,19)
InChI Key:
CJIOXDIWMQEHER-UHFFFAOYSA-N
Properties
Complexity:
348
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
318.122g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
318.329g/mol
Monoisotopic Mass:
318.122g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
78.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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