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

(1-methyl-1H-1,2,4-triazol-5-yl)methanol hydrobromide

CAS No.:
1803601-43-5
Catalog Number:
AG01BC2B
Molecular Formula:
C4H8BrN3O
Molecular Weight:
194.0298
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Product Description
Catalog Number:
AG01BC2B
Chemical Name:
(1-methyl-1H-1,2,4-triazol-5-yl)methanol hydrobromide
CAS Number:
1803601-43-5
Molecular Formula:
C4H8BrN3O
Molecular Weight:
194.0298
MDL Number:
MFCD28714683
IUPAC Name:
(2-methyl-1,2,4-triazol-3-yl)methanol;hydrobromide
InChI:
InChI=1S/C4H7N3O.BrH/c1-7-4(2-8)5-3-6-7;/h3,8H,2H2,1H3;1H
InChI Key:
HFVNIULSFDHTIO-UHFFFAOYSA-N
SMILES:
Cn1ncnc1CO.Br
Properties
Complexity:
77.7  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
192.985g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
194.032g/mol
Monoisotopic Mass:
192.985g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
50.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties