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146472-43-7 | 9H-Xanthene, trimethyl- (9CI)
CAS No: 146472-43-7 Catalog No: AG001E2C MDL No:
Product Description
Catalog Number:
AG001E2C
Chemical Name:
9H-Xanthene, trimethyl- (9CI)
CAS Number:
146472-43-7
Molecular Formula:
C16H16O
Molecular Weight:
224.2976
IUPAC Name:
1,2,3-trimethyl-9H-xanthene
InChI:
InChI=1S/C16H16O/c1-10-8-16-14(12(3)11(10)2)9-13-6-4-5-7-15(13)17-16/h4-8H,9H2,1-3H3
InChI Key:
RRYYZBHNENDSDA-UHFFFAOYSA-N
SMILES:
Cc1cc2Oc3ccccc3Cc2c(c1C)C
Properties
Complexity:
275
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.12g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
224.303g/mol
Monoisotopic Mass:
224.12g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.5
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