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1217-08-9 | 1H-Indene-5-ethanol, 2,3-dihydro-β,1,1,2,3,3-hexamethyl-
CAS No: 1217-08-9 Catalog No: AG0015LQ MDL No:
Product Description
Catalog Number:
AG0015LQ
Chemical Name:
1H-Indene-5-ethanol, 2,3-dihydro-β,1,1,2,3,3-hexamethyl-
CAS Number:
1217-08-9
Molecular Formula:
C17H26O
Molecular Weight:
246.3877
IUPAC Name:
2-(1,1,2,3,3-pentamethyl-2H-inden-5-yl)propan-1-ol
InChI:
InChI=1S/C17H26O/c1-11(10-18)13-7-8-14-15(9-13)17(5,6)12(2)16(14,3)4/h7-9,11-12,18H,10H2,1-6H3
InChI Key:
FADUOCSCUWPALK-UHFFFAOYSA-N
SMILES:
OCC(c1ccc2c(c1)C(C)(C)C(C2(C)C)C)C
EC Number:
214-934-3
UNII:
8Q5V177O23
Properties
Complexity:
305
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
246.198g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
246.394g/mol
Monoisotopic Mass:
246.198g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
4.7
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