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Home > Nitro Compounds > 1306739-07-0
1306739-07-0 | 1-(Ethoxymethyl)-4-nitro-1H-pyrazole
CAS No: 1306739-07-0 Catalog No: AG00HS66 MDL No:
Product Description
Catalog Number:
AG00HS66
Chemical Name:
1-(Ethoxymethyl)-4-nitro-1H-pyrazole
CAS Number:
1306739-07-0
IUPAC Name:
1-(ethoxymethyl)-4-nitropyrazole
InChI:
InChI=1S/C6H9N3O3/c1-2-12-5-8-4-6(3-7-8)9(10)11/h3-4H,2,5H2,1H3
InChI Key:
SDEIRDJUCBOBTO-UHFFFAOYSA-N
Properties
Complexity:
159
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
171.064g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
171.156g/mol
Monoisotopic Mass:
171.064g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
72.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
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