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117173-06-5 | Dodecanimidic acid, methyl ester, hydrochloride (1:1)
CAS No: 117173-06-5 Catalog No: AG000DU7 MDL No:MFCD00204014
Product Description
Catalog Number:
AG000DU7
Chemical Name:
Dodecanimidic acid, methyl ester, hydrochloride (1:1)
CAS Number:
117173-06-5
Molecular Formula:
C13H28ClNO
Molecular Weight:
249.8205
MDL Number:
MFCD00204014
IUPAC Name:
methyl dodecanimidate;hydrochloride
InChI:
InChI=1S/C13H27NO.ClH/c1-3-4-5-6-7-8-9-10-11-12-13(14)15-2;/h14H,3-12H2,1-2H3;1H
InChI Key:
XEKQOJAELNTCFW-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCC(=N)OC.Cl
Properties
Complexity:
146
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
249.186g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
249.823g/mol
Monoisotopic Mass:
249.186g/mol
Rotatable Bond Count:
11
Topological Polar Surface Area:
33.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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