Home Other Building Blocks METHYL-5-AMINOMETHYLNICOTINATE DIHYDROCHLORIDE

METHYL-5-AMINOMETHYLNICOTINATE DIHYDROCHLORIDE

CAS No.:
1006619-16-4
Catalog Number:
AG01DUWK
Molecular Formula:
C8H12Cl2N2O2
Molecular Weight:
239.0991
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Product Description
Catalog Number:
AG01DUWK
Chemical Name:
METHYL-5-AMINOMETHYLNICOTINATE DIHYDROCHLORIDE
CAS Number:
1006619-16-4
Molecular Formula:
C8H12Cl2N2O2
Molecular Weight:
239.0991
MDL Number:
MFCD09834351
IUPAC Name:
methyl 5-(aminomethyl)pyridine-3-carboxylate;dihydrochloride
InChI:
InChI=1S/C8H10N2O2.2ClH/c1-12-8(11)7-2-6(3-9)4-10-5-7;;/h2,4-5H,3,9H2,1H3;2*1H
InChI Key:
XWUJDBZLNZSVMB-UHFFFAOYSA-N
SMILES:
NCc1cncc(c1)C(=O)OC.Cl.Cl
Properties
Complexity:
161  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
238.028g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
239.096g/mol
Monoisotopic Mass:
238.028g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
65.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties