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144126-89-6

144126-89-6 | 1(2H)-Azulenone, 3,3a,4,5,6,7-hexahydro-

CAS No: 144126-89-6 Catalog No: AG001IZE MDL No:

Product Description

Catalog Number:
AG001IZE
Chemical Name:
1(2H)-Azulenone, 3,3a,4,5,6,7-hexahydro-
CAS Number:
144126-89-6
Molecular Formula:
C10H14O
Molecular Weight:
150.2176
IUPAC Name:
3,3a,4,5,6,7-hexahydro-2H-azulen-1-one
InChI:
InChI=1S/C10H14O/c11-10-7-6-8-4-2-1-3-5-9(8)10/h5,8H,1-4,6-7H2
InChI Key:
URKSMUUKSJRDNB-UHFFFAOYSA-N
SMILES:
O=C1CCC2C1=CCCCC2

Properties

Complexity:
203  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
150.104g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
150.221g/mol
Monoisotopic Mass:
150.104g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  

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