Home Other Building Blocks 1-methoxy-3-(1H-1,2,4-triazol-1-yl)propan-2-ol

1-methoxy-3-(1H-1,2,4-triazol-1-yl)propan-2-ol

CAS No.:
76258-78-1
Catalog Number:
AG01A2OS
Molecular Formula:
C6H11N3O2
Molecular Weight:
157.1704
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Product Description
Catalog Number:
AG01A2OS
Chemical Name:
1-methoxy-3-(1H-1,2,4-triazol-1-yl)propan-2-ol
CAS Number:
76258-78-1
Molecular Formula:
C6H11N3O2
Molecular Weight:
157.1704
MDL Number:
MFCD19603548
IUPAC Name:
1-methoxy-3-(1,2,4-triazol-1-yl)propan-2-ol
InChI:
InChI=1S/C6H11N3O2/c1-11-3-6(10)2-9-5-7-4-8-9/h4-6,10H,2-3H2,1H3
InChI Key:
KVTJWIRARMEXAM-UHFFFAOYSA-N
SMILES:
COCC(Cn1cncn1)O
Properties
Complexity:
112  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
157.085g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
157.173g/mol
Monoisotopic Mass:
157.085g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
60.2A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.8  
Properties