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722544-02-7 | Nonanedioic acid, compd. with N-methylmethanamine
CAS No: 722544-02-7 Catalog No: AG005J38 MDL No:
Product Description
Catalog Number:
AG005J38
Chemical Name:
Nonanedioic acid, compd. with N-methylmethanamine
CAS Number:
722544-02-7
Molecular Formula:
C11H23NO4
Molecular Weight:
233.3046
IUPAC Name:
N-methylmethanamine;nonanedioic acid
InChI:
InChI=1S/C9H16O4.C2H7N/c10-8(11)6-4-2-1-3-5-7-9(12)13;1-3-2/h1-7H2,(H,10,11)(H,12,13);3H,1-2H3
InChI Key:
GEZXLKQIVDIXQA-UHFFFAOYSA-N
SMILES:
OC(=O)CCCCCCCC(=O)O.CNC
Properties
Complexity:
150
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.163g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
233.308g/mol
Monoisotopic Mass:
233.163g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
86.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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