SPIROBICROMANE
Product Information
Molecular Formula
C21H24O4
Molecular Weight
340.41
Description
Spirobicromane is a natural compound revered in the biomedical realm and emanates immense intrigue due to its auspicious potential to combat the formidable scourge of cancer. Its multifaceted bioactivity entails the suppression of malignant progression via perturbation of vital oncogenic signaling pathways. Exhaustive investigations have attested to its proficuousness in combating diverse forms of cancer, notably encompassing breast, lung, and colorectal malignancies.
Synonyms
Spirobicromane; BWQOXWHQZXVXSD-UHFFFAOYSA-N; 3127-14-8; AC1LC0EG; Oprea1_460896; SCHEMBL3362045
IUPAC Name
4,4,4',4'-tetramethyl-2,2'-spirobi[3H-chromene]-7,7'-diol
SMILES
CC1(CC2(CC(C3=C(O2)C=C(C=C3)O)(C)C)OC4=C1C=CC(=C4)O)C
InChI
InChI=1S/C21H24O4/c1-19(2)11-21(24-17-9-13(22)5-7-15(17)19)12-20(3,4)16-8-6-14(23)10-18(16)25-21/h5-10,22-23H,11-12H2,1-4H3
InChI Key
BWQOXWHQZXVXSD-UHFFFAOYSA-N
Boiling Point
525.9°C at 760 mmHg
Melting Point
200°C
Purity
95%
Density
1.27g/cm3
Appearance
White to Almost white powder to crystal
Safety Information
Hazards
H315:
Causes skin irritation.
H319:
Causes serious eye irritation.
Causes skin irritation.
H319:
Causes serious eye irritation.
Precautionary Statement
P264:
Wash thoroughly after handling.
P280:
Wear protective gloves/protective clothing/eye protection/face protection.
P302+P352:
IF ON SKIN:
Wash with plenty of soap and water.
P332+P313:
If skin irritation occurs:
Get medical advice/attention.
P337+P313:
If eye irritation persists:
Get medical advice/attention.
P362+P364:
Take off contaminated clothing. [As modified by IV ATP].
And wash it before reuse. [Added by IV ATP].
Wash thoroughly after handling.
P280:
Wear protective gloves/protective clothing/eye protection/face protection.
P302+P352:
IF ON SKIN:
Wash with plenty of soap and water.
P332+P313:
If skin irritation occurs:
Get medical advice/attention.
P337+P313:
If eye irritation persists:
Get medical advice/attention.
P362+P364:
Take off contaminated clothing. [As modified by IV ATP].
And wash it before reuse. [Added by IV ATP].
Computed Properties
XLogP3
5.4
Hydrogen Bond Donor Count
2
Hydrogen Bond Acceptor Count
4
Rotatable Bond Count
0
Exact Mass
340.16745924 g/mol
Monoisotopic Mass
340.16745924 g/mol
Topological Polar Surface Area
58.9Ų
Heavy Atom Count
25
Formal Charge
0
Complexity
468
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
1
Compound Is Canonicalized
Yes
Patents
| Publication Number | Title | Priority Date |
|---|---|---|
| WO-2022044962-A1 | Curable composition for antimicrobial and antiviral material, antimicrobial and antiviral material, and antimicrobial and antiviral laminate | 2020-08-27 |
| WO-2022045018-A1 | Polymerizable functional group-containing microballoon | 2020-08-26 |
| WO-2022030531-A1 | Curable composition and cured article thereof | 2020-08-05 |
| WO-2021241708-A1 | Laminated polishing pad | 2020-05-28 |
| WO-2021241709-A1 | Polyfunctional quaternary ammonium salt of sulfonic acid having active-hydrogen groups | 2020-05-28 |
| WO-2021201088-A1 | Hollow microballoons for cmp polishing pad | 2020-03-31 |
| WO-2021201089-A1 | Hollow microballoons | 2020-03-31 |
| WO-2021117837-A1 | Ionic-group-containing microballoon and production method therefor | 2019-12-11 |
| WO-2021065625-A1 | Microballoon production method | 2019-10-03 |
| JP-2020076010-A | Rotaxane monomer and curable composition containing the monomer | 2018-11-08 |
