Home Other Building Blocks 4H-1,2,4-TRIAZOLE-4-PROPANOL

4H-1,2,4-TRIAZOLE-4-PROPANOL

CAS No.:
27106-94-1
Catalog Number:
AG00BCBT
Molecular Formula:
C5H9N3O
Molecular Weight:
127.1445
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG00BCBT
Chemical Name:
4H-1,2,4-TRIAZOLE-4-PROPANOL
CAS Number:
27106-94-1
Molecular Formula:
C5H9N3O
Molecular Weight:
127.1445
MDL Number:
MFCD03840804
IUPAC Name:
3-(1,2,4-triazol-4-yl)propan-1-ol
InChI:
InChI=1S/C5H9N3O/c9-3-1-2-8-4-6-7-5-8/h4-5,9H,1-3H2
InChI Key:
PSFQZUIYYGSLQU-UHFFFAOYSA-N
SMILES:
OCCCn1cnnc1
Properties
Complexity:
72.6  
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:
3  
Topological Polar Surface Area:
50.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1  
Properties