Home Carboxys 5-Nitro-1h-indazole-7-carboxylic acid methyl ester

5-Nitro-1h-indazole-7-carboxylic acid methyl ester

CAS No.:
632291-85-1
Catalog Number:
AG00IB6D
Molecular Formula:
C9H7N3O4
Molecular Weight:
221.1696
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
≥ 95% (HPLC)
1 week
United States
$227
- +
1g
≥ 95% (HPLC)
1 week
United States
$417
- +
5g
≥ 95% (HPLC)
1 week
United States
$1778
- +
Product Description
Catalog Number:
AG00IB6D
Chemical Name:
5-Nitro-1h-indazole-7-carboxylic acid methyl ester
CAS Number:
632291-85-1
Molecular Formula:
C9H7N3O4
Molecular Weight:
221.1696
MDL Number:
MFCD03990536
IUPAC Name:
methyl 5-nitro-1H-indazole-7-carboxylate
InChI:
InChI=1S/C9H7N3O4/c1-16-9(13)7-3-6(12(14)15)2-5-4-10-11-8(5)7/h2-4H,1H3,(H,10,11)
InChI Key:
MZSTUEANQBHBNG-UHFFFAOYSA-N
SMILES:
COC(=O)c1cc(cc2c1[nH]nc2)[N+](=O)[O-]
Properties
Complexity:
304  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.044g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
221.172g/mol
Monoisotopic Mass:
221.044g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
101A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties