Home Other Building Blocks 5-(methoxymethyl)-3-methyl-1H-1,2,4-triazole

5-(methoxymethyl)-3-methyl-1H-1,2,4-triazole

CAS No.:
89417-85-6
Catalog Number:
AG01A122
Molecular Formula:
C5H9N3O
Molecular Weight:
127.1445
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Product Description
Catalog Number:
AG01A122
Chemical Name:
5-(methoxymethyl)-3-methyl-1H-1,2,4-triazole
CAS Number:
89417-85-6
Molecular Formula:
C5H9N3O
Molecular Weight:
127.1445
MDL Number:
MFCD14611319
IUPAC Name:
3-(methoxymethyl)-5-methyl-1H-1,2,4-triazole
InChI:
InChI=1S/C5H9N3O/c1-4-6-5(3-9-2)8-7-4/h3H2,1-2H3,(H,6,7,8)
InChI Key:
SKGYUAPCEREGNQ-UHFFFAOYSA-N
SMILES:
COCc1[nH]nc(n1)C
Properties
Complexity:
88.3  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
127.075g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
127.147g/mol
Monoisotopic Mass:
127.075g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
50.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1  
Properties