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Home > Other Heterocycles > 2060061-29-0
2060061-29-0 | 1-methyl-5-{4-methyl-7-oxabicyclo[4.1.0]heptan-1-yl}-1H-pyrazole
CAS No: 2060061-29-0 Catalog No: AG01BQCH MDL No:MFCD30501273
Product Description
Catalog Number:
AG01BQCH
Chemical Name:
1-methyl-5-{4-methyl-7-oxabicyclo[4.1.0]heptan-1-yl}-1H-pyrazole
CAS Number:
2060061-29-0
Molecular Formula:
C11H16N2O
Molecular Weight:
192.2575
MDL Number:
MFCD30501273
IUPAC Name:
1-methyl-5-(4-methyl-7-oxabicyclo[4.1.0]heptan-1-yl)pyrazole
InChI:
InChI=1S/C11H16N2O/c1-8-3-5-11(10(7-8)14-11)9-4-6-12-13(9)2/h4,6,8,10H,3,5,7H2,1-2H3
InChI Key:
ONZJONIQHGYJFS-UHFFFAOYSA-N
SMILES:
CC1CCC2(C(C1)O2)c1ccnn1C
Properties
Complexity:
245
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
192.126g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
192.262g/mol
Monoisotopic Mass:
192.126g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
30.4A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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