200,000+ products from a single source!
sales@angenechem.com
169128-31-8 | Carbamic acid, dimethyl-, 2-[(butylmethylamino)methyl]-3-pyridinyl ester, ethanedioate (1:1) (9CI)
CAS No: 169128-31-8 Catalog No: AG001YHI MDL No:
Product Description
Catalog Number:
AG001YHI
Chemical Name:
Carbamic acid, dimethyl-, 2-[(butylmethylamino)methyl]-3-pyridinyl ester, ethanedioate (1:1) (9CI)
CAS Number:
169128-31-8
Molecular Formula:
C16H25N3O6
Molecular Weight:
355.3862
IUPAC Name:
[2-[[butyl(methyl)amino]methyl]pyridin-3-yl] N,N-dimethylcarbamate;oxalic acid
InChI:
InChI=1S/C14H23N3O2.C2H2O4/c1-5-6-10-17(4)11-12-13(8-7-9-15-12)19-14(18)16(2)3;3-1(4)2(5)6/h7-9H,5-6,10-11H2,1-4H3;(H,3,4)(H,5,6)
InChI Key:
PQJYWYLRWKREQT-UHFFFAOYSA-N
SMILES:
OC(=O)C(=O)O.CCCCN(Cc1ncccc1OC(=O)N(C)C)C
Properties
Complexity:
343
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
355.174g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
355.391g/mol
Monoisotopic Mass:
355.174g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
120A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.