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1275393-33-3

1275393-33-3 | N-[(2-methoxypyridin-4-yl)methyl]guanidine

CAS No: 1275393-33-3 Catalog No: AG01AUNA MDL No:MFCD17270994

Product Description

Catalog Number:
AG01AUNA
Chemical Name:
N-[(2-methoxypyridin-4-yl)methyl]guanidine
CAS Number:
1275393-33-3
Molecular Formula:
C8H12N4O
Molecular Weight:
180.2071
MDL Number:
MFCD17270994
IUPAC Name:
2-[(2-methoxypyridin-4-yl)methyl]guanidine
InChI:
InChI=1S/C8H12N4O/c1-13-7-4-6(2-3-11-7)5-12-8(9)10/h2-4H,5H2,1H3,(H4,9,10,12)
InChI Key:
MQMJOFPHEKFWKP-UHFFFAOYSA-N
SMILES:
COc1nccc(c1)CNC(=N)N

Properties

Complexity:
179  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
180.101g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
180.211g/mol
Monoisotopic Mass:
180.101g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
86.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.4  

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