2- (Hydroxymethyl) anthraquinone

CAT: 0804-HY-N7502-01Size: 100 mgDry Ice: NoHazardous: No

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CAT#:0804-HY-N7502-01Size:100 mg

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Description

2- (Hydroxymethyl) anthraquinone is used as a photoremovable protecting group (PRPG) to chemically cage sex pheromone (e.g. (Z) -11-hexadecen-1-ol (sex pheromone of Chilo infuscatellussnellen) ) [1].

CAS Number

17241-59-7

UNSPSC

12352005

Hazard Statement

H302

Target

Others

Type

Natural Products

Related Pathways

Others

Field of Research

Others

Assay Protocol

https://www.medchemexpress.com/2-hydroxymethyl-anthraquinone.html

Concentration

10mM

Purity

97.22

Solubility

DMSO : 100 mg/mL (ultrasonic)

Smiles

O=C1C2=C(C=CC=C2)C(C3=CC=C(CO)C=C13)=O

Molecular Formula

C15H10O3

Molecular Weight

238.24

Precautions

H302

References & Citations

[1]Sanghamitra Atta, et al. Photoremovable protecting groups as controlled-release device for sex pheromone. Photochem Photobiol Sci. 2013 Feb;12 (2) :393-403

Shipping Conditions

Room Temperature

Storage Conditions

-20°C, 3 years; 4°C, 2 years (Powder)

Scientific Category

Natural Products

Clinical Information

No Development Reported

Chemical Information

2-(Hydroxymethyl)anthraquinone

2-(hydroxymethyl)anthraquinone is an anthraquinone. It has a role as a metabolite.

CAS Number	17241-59-7
PubChem CID	87014
IUPAC Name	2-(hydroxymethyl)anthracene-9,10-dione
Molecular Formula	C15H10O3
Molecular Weight	238.24
XLogP	2.7
Topological Polar Surface Area	54.4
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	1
Heavy Atom Count	18
Formal Charge	0
Complexity	363

SMILES

C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C=C(C=C3)CO

InChI

InChI=1S/C15H10O3/c16-8-9-5-6-12-13(7-9)15(18)11-4-2-1-3-10(11)14(12)17/h1-7,16H,8H2

InChIKey

JYKHAJGLEVKEAA-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 17241-59-7

CID: 87014

Formula: C15H10O3

MW: 238.24

Interactive 3D Structure

Loading 3D structure...

View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	238.24
XLogP3	2.7
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	1
Exact Mass	238.062994177
Monoisotopic Mass	238.062994177
Topological Polar Surface Area	54.4 Å²
Heavy Atom Count	18
Formal Charge	0
Complexity	363
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

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2- (Hydroxymethyl) anthraquinone

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