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1158447-85-8

1158447-85-8 | 3-Pyridinemethanamine, 2-methoxy-, hydrochloride (1:2)

CAS No: 1158447-85-8 Catalog No: AG000GXT MDL No:MFCD23703574

Product Description

Catalog Number:
AG000GXT
Chemical Name:
3-Pyridinemethanamine, 2-methoxy-, hydrochloride (1:2)
CAS Number:
1158447-85-8
Molecular Formula:
C7H12Cl2N2O
Molecular Weight:
211.0890
MDL Number:
MFCD23703574
IUPAC Name:
(2-methoxypyridin-3-yl)methanamine;dihydrochloride
InChI:
InChI=1S/C7H10N2O.2ClH/c1-10-7-6(5-8)3-2-4-9-7;;/h2-4H,5,8H2,1H3;2*1H
InChI Key:
DWPUKTYKLMMLSY-UHFFFAOYSA-N
SMILES:
COc1ncccc1CN.Cl.Cl

Properties

Complexity:
97.6  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.033g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
211.086g/mol
Monoisotopic Mass:
210.033g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
48.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

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