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89780-06-3 | 1-methoxy-3,5,5,8,8-pentamethyl-tetralin-2-carbaldehyde
CAS No: 89780-06-3 Catalog No: AG00409G MDL No:
Product Description
Catalog Number:
AG00409G
Chemical Name:
1-methoxy-3,5,5,8,8-pentamethyl-tetralin-2-carbaldehyde
CAS Number:
89780-06-3
Molecular Formula:
C17H26O2
Molecular Weight:
262.3871
IUPAC Name:
1-methoxy-3,5,5,8,8-pentamethyl-6,7-dihydronaphthalene-2-carbaldehyde
InChI:
InChI=1S/C17H24O2/c1-11-9-13-14(15(19-6)12(11)10-18)17(4,5)8-7-16(13,2)3/h9-10H,7-8H2,1-6H3
InChI Key:
WPUPOYSDTDHCGJ-UHFFFAOYSA-N
SMILES:
COC1C(C=O)C(C)CC2=C1C(C)(C)C=CC2(C)C
Properties
Complexity:
345
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
260.178g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
260.377g/mol
Monoisotopic Mass:
260.178g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.8
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