200,000+ products from a single source!
sales@angenechem.com
128457-91-0 | Benzenemethanamine, N,N-dimethyl-, ethanedioate (1:1)
CAS No: 128457-91-0 Catalog No: AG000Y53 MDL No:
Product Description
Catalog Number:
AG000Y53
Chemical Name:
Benzenemethanamine, N,N-dimethyl-, ethanedioate (1:1)
CAS Number:
128457-91-0
Molecular Formula:
C11H15NO4
Molecular Weight:
225.2411
IUPAC Name:
N,N-dimethyl-1-phenylmethanamine;oxalic acid
InChI:
InChI=1S/C9H13N.C2H2O4/c1-10(2)8-9-6-4-3-5-7-9;3-1(4)2(5)6/h3-7H,8H2,1-2H3;(H,3,4)(H,5,6)
InChI Key:
IYWSYVMVRRFMKX-UHFFFAOYSA-N
SMILES:
OC(=O)C(=O)O.CN(Cc1ccccc1)C
Properties
Complexity:
154
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
225.1g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
225.244g/mol
Monoisotopic Mass:
225.1g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
77.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.