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5,7-Dimethoxy-4H-1-benzopyran-4-one

HCID 12378005
NotesReactions
Basic informationOverviewNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
59887-91-1
Standard SMILES
COc1cc(OC)c2c(=O)ccoc2c1
InChIKey
KTYBWRXYZHFNSL-UHFFFAOYSA-N
Molecular formula
C11H10O4
Average molar mass
206.19 g/mol
Monoisotopic mass
206.0579088

Overview

5,7-Dimethoxy-4H-1-benzopyran-4-one has been reported in Artemisia crithmifolia and Artemisia campestris with data available.

Names & identifiers

Preferred name
5,7-Dimethoxy-4H-1-benzopyran-4-one
IUPAC
5,7-dimethoxychromen-4-one
English name
4H-1-Benzopyran-4-one, 5,7-diMethoxy-
Molecular formula
C11H10O4
Molecular weight
206.19

Names & synonyms

59887-91-15,7-Dimethoxychromone5,7-Dimethoxy-4H-chromen-4-one5,7-dimethoxychromen-4-one5,7-Dimethoxy-4H-1-benzopyran-4-one4H-1-Benzopyran-4-one, 5,7-dimethoxy-5,7-dimethoxy-4-chromenoneSCHEMBL1472177DTXSID70495247DLB51982G82653EN300-7356591
Show more names
F555824Z1551916016

Database identifiers

CAS
59887-91-1
PubChem CID
12378005
DTXSID
DTXSID70495247
Nikkaji
J1.032.930B

Properties

Computed structural properties

XLogP
1.5
Topological polar surface area
44.8 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
2
Heavy atoms
15
Formal charge
0
Complexity
274

Physicochemical properties

storage temp.
Store at room temperature
Appearance
Light yellow to yellow Solid
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
302 · H302-H315-H319-H335
Precautionary statements
280 · P280-P305+P351+P338

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Safety data

Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H302-H315-H319-H335
Precautionary statements
P280-P305+P351+P338

Chemistry & industry

Upstream & downstream products

Downstream products

Pinostrobin

Suppliers5 total

杭州迈世腾药物科技有限公司0571-82896630 18969958410 · [email protected]
上海麦克林生化科技股份有限公司50706066 15221275939 · [email protected]
合肥诚权生物科技有限公司0551-0551130 13034045150
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
烟台盛凯伦化学科技有限公司开发区第一分公司13356901049 · [email protected]

Related reactions

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Compound notes

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On this pageBasic informationOverviewNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes