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Home > Other Heterocycles > 77377-09-4
77377-09-4 | spiro[1,3-benzodioxole-2,1'-cyclopentane]-6-ol
CAS No: 77377-09-4 Catalog No: AG01B97L MDL No:MFCD24718516
Product Description
Catalog Number:
AG01B97L
Chemical Name:
spiro[1,3-benzodioxole-2,1'-cyclopentane]-6-ol
CAS Number:
77377-09-4
Molecular Formula:
C11H12O3
Molecular Weight:
192.2112
MDL Number:
MFCD24718516
IUPAC Name:
spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-ol
InChI:
InChI=1S/C11H12O3/c12-8-3-4-9-10(7-8)14-11(13-9)5-1-2-6-11/h3-4,7,12H,1-2,5-6H2
InChI Key:
LSRNDLVWXGANRZ-UHFFFAOYSA-N
SMILES:
Oc1ccc2c(c1)OC1(O2)CCCC1
Properties
Complexity:
223
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
192.079g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
192.214g/mol
Monoisotopic Mass:
192.079g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
38.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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