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116570-81-1

116570-81-1 | 1H-Pyrazole, 3-ethoxy-4,5-dimethyl-

CAS No: 116570-81-1 Catalog No: AG000CT2 MDL No:

Product Description

Catalog Number:
AG000CT2
Chemical Name:
1H-Pyrazole, 3-ethoxy-4,5-dimethyl-
CAS Number:
116570-81-1
Molecular Formula:
C7H12N2O
Molecular Weight:
140.1830
IUPAC Name:
3-ethoxy-4,5-dimethyl-1H-pyrazole
InChI:
InChI=1S/C7H12N2O/c1-4-10-7-5(2)6(3)8-9-7/h4H2,1-3H3,(H,8,9)
InChI Key:
QHBRIXCDOGTYNX-UHFFFAOYSA-N
SMILES:
CCOc1n[nH]c(c1C)C

Properties

Complexity:
108  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
140.095g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
140.186g/mol
Monoisotopic Mass:
140.095g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
37.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  

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