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Home > Other Building Blocks > 199986-64-6
199986-64-6 | 3-Phenanthrenol, 7,8-dimethyl-2-(1-methylethyl)-
CAS No: 199986-64-6 Catalog No: AG002CHU MDL No:
Product Description
Catalog Number:
AG002CHU
Chemical Name:
3-Phenanthrenol, 7,8-dimethyl-2-(1-methylethyl)-
CAS Number:
199986-64-6
Molecular Formula:
C19H20O
Molecular Weight:
264.3615
IUPAC Name:
7,8-dimethyl-2-propan-2-ylphenanthren-3-ol
InChI:
InChI=1S/C19H20O/c1-11(2)17-9-14-6-8-15-13(4)12(3)5-7-16(15)18(14)10-19(17)20/h5-11,20H,1-4H3
InChI Key:
ZMSKUQUFEKLXGK-UHFFFAOYSA-N
SMILES:
CC(c1cc2ccc3c(c2cc1O)ccc(c3C)C)C
Properties
Complexity:
337
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
264.151g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
264.368g/mol
Monoisotopic Mass:
264.151g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.9
Literature
| Title | Journal |
|---|---|
| Antimycobacterial plant terpenoids. | Planta medica 20011101 |
| Norditerpenoids and diterpenoids from Salvia multicaulis with antituberculous activity. | Journal of natural products 19971201 |
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