1,2-BENZOPYRAN

Details

Stereochemistry	ACHIRAL
Molecular Formula	C9H8O
Molecular Weight	132.1592
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

C1OC2=C(C=C1)C=CC=C2

InChI

InChIKey=KYNSBQPICQTCGU-UHFFFAOYSA-N

InChI=1S/C9H8O/c1-2-6-9-8(4-1)5-3-7-10-9/h1-6H,7H2

HIDE SMILES / InChI

Molecular Formula	C9H8O
Molecular Weight	132.1592
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

PubMed

Title	Date	PubMed
Structure-activity relationships of a novel class of endothelin-A receptor antagonists and discovery of potent and selective receptor antagonist, 2-(benzo[1,3]dioxol-5-yl)-6-isopropyloxy-4-(4-methoxyphenyl)-2H-chromene-3-carboxylic acid (S-1255). 1. Study on structure-activity relationships and basic structure crucial for ET(A) antagonism.	2002 May 9	11985472
Total synthesis of the highly potent anti-HIV natural product daurichromenic acid along with its two chromane derivatives, rhododaurichromanic acids A and B.	2003 Nov 13	14602030
Synthesis and structure-activity relationships of analogs of EM-652 (acolbifene), a pure selective estrogen receptor modulator. Study of nitrogen substitution.	2005 Apr	15968821
Phenylboronic acid mediated triple condensation reactions of phloroglucinol and unsaturated carbonyl compounds.	2005 Feb 3	15673266
The ring-opening reaction of chromenes: a photochemical mode-dependent transformation.	2005 Oct 6	16834270
Efficient photochemical merocyanine-to-spiropyran ring closure mechanism through an extended conical intersection seam. A model CASSCF/CASPT2 study.	2006 Mar 23	16539421
Chaetopyranin, a benzaldehyde derivative, and other related metabolites from Chaetomium globosum, an endophytic fungus derived from the marine red alga Polysiphonia urceolata.	2006 Nov	17125234
Direct stereocontrolled synthesis of polyoxygenated hydrobenzofurans and hydrobenzopyrans from p-peroxy quinols.	2007 Nov 22	17973482
Synthesis, IR, UV/vis-, (1)H NMR and DFT study of chelatophore functionalized 1,3-benzoxazinone spiropyrans.	2008 Dec 1	18550424
Synthesis and pharmacological evaluation of coumarin derivatives as cannabinoid receptor antagonists and inverse agonists.	2009 Apr 1	19278853
A novel chelatofore functionalized spiropyran of the 2-oxaindane series.	2009 Dec	19966444
Phorbaketals A, B, and C, sesterterpenoids with a spiroketal of hydrobenzopyran moiety isolated from the marine sponge Phorbas sp.	2009 Dec 17	19921795
A forward chemical screen using zebrafish embryos with novel 2-substituted 2H-chromene derivatives.	2009 Mar	19207470
Effects of diumancal and decursinol on 5-hydroxytryptamine level in rat brain.	2009 Sep	19801740
Small molecule screening in zebrafish: an in vivo approach to identifying new chemical tools and drug leads.	2010 Jun 12	20540792
3-{2-[2-(3-Hy-droxy-benzyl-idene)hydrazin-1-yl]-1,3-thia-zol-4-yl}-2H-chromen-2-one hemihydrate.	2010 May 29	21579559
(E)-1-[1-(6-Bromo-2-oxo-2H-chromen-3-yl)ethyl-idene]thio-semicarbazide.	2010 May 29	21579554
3-Acetyl-4-hy-droxy-6,7-dimethyl-2H-chromen-2-one.	2010 Nov 13	21589432
New 4H-chromen-4-one and 2H-chromene derivatives as anti-picornavirus capsid-binders.	2010 Sep 1	20673722

Patents

Substance Class	Chemical Created by `admin` on `Fri Dec 15 18:59:43 GMT 2023` Edited by `admin` on `Fri Dec 15 18:59:43 GMT 2023`
Record UNII	7U3W6XRV5U
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

1,2-BENZOPYRAN

Common Name

English

1,2-BENZOPYRAN [MI]

Common Name

English

1,2-CHROMENE

Common Name

English

3-CHROMENE

Common Name

English

2H-1-BENZOPYRAN

Systematic Name

English

Code System Code Type Description

PUBCHEM

9211