Benzindene Triol manufacturers and suppliers on PharmaCompass

Chemistry

Click the arrow to open the dropdown
read-moreClick the button for full data set
Also known as:
Molecular Formula
C13H10O3
Molecular Weight
214.22  g/mol
InChI Key
MGBQSTRJZWMQBF-UHFFFAOYSA-N

Benzindene Triol
1 2D Structure

Benzindene Triol

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
1H-cyclopenta[a]naphthalene-1,2,3-triol
2.1.2 InChI
InChI=1S/C13H10O3/c14-11-9-6-5-7-3-1-2-4-8(7)10(9)12(15)13(11)16/h1-6,12,14-16H
2.1.3 InChI Key
MGBQSTRJZWMQBF-UHFFFAOYSA-N
2.1.4 Canonical SMILES
C1=CC=C2C(=C1)C=CC3=C2C(C(=C3O)O)O
2.2 Create Date
2015-02-02
3 Chemical and Physical Properties
Molecular Weight 214.22 g/mol
Molecular Formula C13H10O3
XLogP31.6
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count3
Rotatable Bond Count0
Exact Mass214.062994177 g/mol
Monoisotopic Mass214.062994177 g/mol
Topological Polar Surface Area60.7 Ų
Heavy Atom Count16
Formal Charge0
Complexity323
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1
Ask Us for Pharmaceutical Supplier and Partner
Ask Us, Find A Supplier / Partner
No Commissions, No Strings Attached, Get Connected for FREE

What are you looking for?

How can we help you?

The request can't be empty

Please read our Privacy Policy carefully

You must agree to the privacy policy

The name can't be empty
The company can't be empty.
The email can't be empty Please enter a valid email.
The mobile can't be empty