Home Other Building Blocks (2-ethyl-2H-1,2,3-triazol-4-yl)methanol

(2-ethyl-2H-1,2,3-triazol-4-yl)methanol

CAS No.:
76320-99-5
Catalog Number:
AG01AN7Q
Molecular Formula:
C5H9N3O
Molecular Weight:
127.1445
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Product Description
Catalog Number:
AG01AN7Q
Chemical Name:
(2-ethyl-2H-1,2,3-triazol-4-yl)methanol
CAS Number:
76320-99-5
Molecular Formula:
C5H9N3O
Molecular Weight:
127.1445
MDL Number:
MFCD28246717
IUPAC Name:
(2-ethyltriazol-4-yl)methanol
InChI:
InChI=1S/C5H9N3O/c1-2-8-6-3-5(4-9)7-8/h3,9H,2,4H2,1H3
InChI Key:
DYMLSMNRTGELQI-UHFFFAOYSA-N
SMILES:
OCc1cnn(n1)CC
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:
50.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3  
Properties