Basic information
- CAS
57543-38-1- Standard SMILES
COc1cccc2c1OCC(C=O)=C2- InChIKey
XLGMCLXPMVMVRJ-UHFFFAOYSA-N- Molecular formula
- C11H10O3
- Average molar mass
- 190.19 g/mol
- Monoisotopic mass
- 190.06299418
Names & identifiers
- Preferred name
- 2H-1-Benzopyran-3-carboxaldehyde, 8-methoxy-
- IUPAC
- 8-methoxy-2H-chromene-3-carbaldehyde
- English name
- 8-Methoxy-2H-1-benzopyran-3-carbaldehyde
- Molecular formula
- C11H10O3
- Molecular weight
- 190.2
Names & synonyms
57543-38-12H-1-BENZOPYRAN-3-CARBOXALDEHYDE, 8-METHOXY-DTXSID60206162RefChem:1065190DTXCID601286538-methoxy-2H-chromene-3-carbaldehyde8-Methoxy-2H-1-benzopyran-3-carbaldehydeMFCD01662420SCHEMBL8628781SCHEMBL31546944XLGMCLXPMVMVRJ-UHFFFAOYSA-N8-Methoxy-chromene 3-Carboxaldehyde
Show more names
8-methoxy-2H-chromene-3-carbaldehyde(SALTDATA: FREE)
AKOS000126238BS-38314DB-028476CS-04538578-Methoxy-2H-chromene-3-carbaldehyde, AldrichCPRF308641
Database identifiers
- CAS
57543-38-1- PubChem CID
- 42428
- DTXSID
DTXSID60206162- Nikkaji
- J132.074B
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 247
Physicochemical properties
- form
- solid
- InChI
- 1S/C11H10O3/c1-13-10-4-2-3-9-5-8(6-12)7-14-11(9)10/h2-6H,7H2,1H3
- InChIKey
- XLGMCLXPMVMVRJ-UHFFFAOYSA-N
- SMILES
- COc1cccc2C=C(COc12)C=O
- UNSPSC Code
- 12352200 · 12352200
- WGK Germany
- 3 · WGK 3
- Storage Class
- 11 · 11 - Combustible Solids
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
- wgk
- WGK 3
- Storage Class
- 11 - Combustible Solids
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers6 total
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
Aladdin Scientific[email protected]
上海安米克化学品有限公司微信 18019252918 18019252918 · [email protected]
上海阿拉丁生化科技股份有限公司6206333 13167063860 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 13913916777 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
Related reactions
3 records
Compound notes
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