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Home > Other Heterocycles > 16076-17-8
16076-17-8 | Bicyclo[2.2.0]hex-5-ene-2,3-diol, 1,2,3,4,5,6-hexamethyl-
CAS No: 16076-17-8 Catalog No: AG001VBR MDL No:
Product Description
Catalog Number:
AG001VBR
Chemical Name:
Bicyclo[2.2.0]hex-5-ene-2,3-diol, 1,2,3,4,5,6-hexamethyl-
CAS Number:
16076-17-8
Molecular Formula:
C12H20O2
Molecular Weight:
196.2860
IUPAC Name:
1,2,3,4,5,6-hexamethylbicyclo[2.2.0]hex-5-ene-2,3-diol
InChI:
InChI=1S/C12H20O2/c1-7-8(2)10(4)9(7,3)11(5,13)12(10,6)14/h13-14H,1-6H3
InChI Key:
KQTAULOVDOGRQP-UHFFFAOYSA-N
SMILES:
CC1=C(C)C2(C1(C)C(C2(C)O)(C)O)C
NSC Number:
125875
Properties
Complexity:
325
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.146g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
196.29g/mol
Monoisotopic Mass:
196.146g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
4
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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