Home Halogens 5-bromo-1-(cyclopropylmethyl)-1H-1,2,4-triazole

5-bromo-1-(cyclopropylmethyl)-1H-1,2,4-triazole

CAS No.:
2091652-88-7
Catalog Number:
AG01BS6K
Molecular Formula:
C6H8BrN3
Molecular Weight:
202.0518
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Product Description
Catalog Number:
AG01BS6K
Chemical Name:
5-bromo-1-(cyclopropylmethyl)-1H-1,2,4-triazole
CAS Number:
2091652-88-7
Molecular Formula:
C6H8BrN3
Molecular Weight:
202.0518
MDL Number:
MFCD31381276
IUPAC Name:
5-bromo-1-(cyclopropylmethyl)-1,2,4-triazole
InChI:
InChI=1S/C6H8BrN3/c7-6-8-4-9-10(6)3-5-1-2-5/h4-5H,1-3H2
InChI Key:
ILWKBKRMLLVIHX-UHFFFAOYSA-N
SMILES:
Brc1ncnn1CC1CC1
Properties
Complexity:
126  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
200.99g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
202.055g/mol
Monoisotopic Mass:
200.99g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
30.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties