9-(Hydroxymethyl)-2,3,6-trimethoxyphenanthrene - CAS 30062-14-7
Catalog: |
BB020430 |
Product Name: |
9-(Hydroxymethyl)-2,3,6-trimethoxyphenanthrene |
CAS: |
30062-14-7 |
Synonyms: |
(2,3,6-trimethoxy-9-phenanthrenyl)methanol; (2,3,6-trimethoxyphenanthren-9-yl)methanol |
IUPAC Name: | (2,3,6-trimethoxyphenanthren-9-yl)methanol |
Description: | 9-(Hydroxymethyl)-2,3,6-trimethoxyphenanthrene (CAS# 30062-14-7 ) is a useful research chemical. |
Molecular Weight: | 298.33 |
Molecular Formula: | C18H18O4 |
Canonical SMILES: | COC1=CC2=C3C=C(C(=CC3=CC(=C2C=C1)CO)OC)OC |
InChI: | InChI=1S/C18H18O4/c1-20-13-4-5-14-12(10-19)6-11-7-17(21-2)18(22-3)9-15(11)16(14)8-13/h4-9,19H,10H2,1-3H3 |
InChI Key: | QAEVXOPQWYSOSR-UHFFFAOYSA-N |
LogP: | 3.51110 |
Complexity: | 361 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 298.12050905 |
Formal Charge: | 0 |
Heavy Atom Count: | 22 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 298.12050905 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 47.9 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.4 |
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