Home Carboxys Methyl 1,4,6,7-tetrahydropyrano[4,3-c]pyrazole-3-carboxylate

Methyl 1,4,6,7-tetrahydropyrano[4,3-c]pyrazole-3-carboxylate

CAS No.:
1211479-06-9
Catalog Number:
AG00IMM8
Molecular Formula:
C8H10N2O3
Molecular Weight:
182.1766
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Product Description
Catalog Number:
AG00IMM8
Chemical Name:
Methyl 1,4,6,7-tetrahydropyrano[4,3-c]pyrazole-3-carboxylate
CAS Number:
1211479-06-9
Molecular Formula:
C8H10N2O3
Molecular Weight:
182.1766
MDL Number:
MFCD20921989
IUPAC Name:
methyl 1,4,6,7-tetrahydropyrano[4,3-c]pyrazole-3-carboxylate
InChI:
InChI=1S/C8H10N2O3/c1-12-8(11)7-5-4-13-3-2-6(5)9-10-7/h2-4H2,1H3,(H,9,10)
InChI Key:
ZWJXUKXNOYFBSQ-UHFFFAOYSA-N
SMILES:
COC(=O)c1n[nH]c2c1COCC2
Properties
Complexity:
210  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
182.069g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
182.179g/mol
Monoisotopic Mass:
182.069g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
64.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1  
Properties