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Home Carboxys Methyl 1-tert-butyl-1,2,3-benzotriazole-5-carboxylate

Methyl 1-tert-butyl-1,2,3-benzotriazole-5-carboxylate

CAS No.:
1400645-11-5
Catalog Number:
AG009X4G
Molecular Formula:
C12H15N3O2
Molecular Weight:
233.2664
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$75
- +
5g
97%
In Stock USA
United States
$225
- +
Product Description
Catalog Number:
AG009X4G
Chemical Name:
Methyl 1-tert-butyl-1,2,3-benzotriazole-5-carboxylate
CAS Number:
1400645-11-5
Molecular Formula:
C12H15N3O2
Molecular Weight:
233.2664
MDL Number:
MFCD22421554
IUPAC Name:
methyl 1-tert-butylbenzotriazole-5-carboxylate
InChI:
InChI=1S/C12H15N3O2/c1-12(2,3)15-10-6-5-8(11(16)17-4)7-9(10)13-14-15/h5-7H,1-4H3
InChI Key:
BGFNUHCYHZDKKU-UHFFFAOYSA-N
SMILES:
COC(=O)c1ccc2c(c1)nnn2C(C)(C)C
Properties
Complexity:
301  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.116g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
233.271g/mol
Monoisotopic Mass:
233.116g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
57A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Properties