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Home Other Building Blocks 2-(4-formyl-3,5-dimethyl-1H-pyrazol-1-yl)ethyl acetate

2-(4-formyl-3,5-dimethyl-1H-pyrazol-1-yl)ethyl acetate

CAS No.:
1610378-55-6
Catalog Number:
AG01EM9N
Molecular Formula:
C10H14N2O3
Molecular Weight:
210.2298
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Product Description
Catalog Number:
AG01EM9N
Chemical Name:
2-(4-formyl-3,5-dimethyl-1H-pyrazol-1-yl)ethyl acetate
CAS Number:
1610378-55-6
Molecular Formula:
C10H14N2O3
Molecular Weight:
210.2298
MDL Number:
MFCD31665664
IUPAC Name:
2-(4-formyl-3,5-dimethylpyrazol-1-yl)ethyl acetate
InChI:
InChI=1S/C10H14N2O3/c1-7-10(6-13)8(2)12(11-7)4-5-15-9(3)14/h6H,4-5H2,1-3H3
InChI Key:
YAUKYMFWBWPVRN-UHFFFAOYSA-N
SMILES:
O=Cc1c(C)nn(c1C)CCOC(=O)C
Properties
Complexity:
245  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.1g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
210.233g/mol
Monoisotopic Mass:
210.1g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
61.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3  
Properties