Home Other Building Blocks (5-methyl-1H-1,2,3-triazol-4-yl)methanamine

(5-methyl-1H-1,2,3-triazol-4-yl)methanamine

CAS No.:
933692-48-9
Catalog Number:
AG01A4K7
Molecular Formula:
C4H8N4
Molecular Weight:
112.1331
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01A4K7
Chemical Name:
(5-methyl-1H-1,2,3-triazol-4-yl)methanamine
CAS Number:
933692-48-9
Molecular Formula:
C4H8N4
Molecular Weight:
112.1331
MDL Number:
MFCD30147841
IUPAC Name:
(5-methyl-2H-triazol-4-yl)methanamine
InChI:
InChI=1S/C4H8N4/c1-3-4(2-5)7-8-6-3/h2,5H2,1H3,(H,6,7,8)
InChI Key:
AIYYCTFJYZYMFZ-UHFFFAOYSA-N
SMILES:
Cc1c(CN)nn[nH]1
Properties
Complexity:
74.4  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
112.075g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
112.136g/mol
Monoisotopic Mass:
112.075g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
67.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.1  
Properties