Basic information
- CAS
60082-02-2- Standard SMILES
CN1CCc2cc(C=O)ccc21- InChIKey
OZQGVTARHLDSTI-UHFFFAOYSA-N- Molecular formula
- C10H11NO
- Average molar mass
- 161.2 g/mol
- Monoisotopic mass
- 161.08406397
Names & identifiers
- Preferred name
- 1-Methylindoline-5-carbaldehyde
- IUPAC
- 1-methyl-2,3-dihydroindole-5-carbaldehyde
- English name
- 1-Methylindoline-5-carboxaldehyde
- Molecular formula
- C10H11NO
- Molecular weight
- 161.2
Names & synonyms
1-methylindoline-5-carbaldehyde60082-02-2DTXSID30344222RefChem:232071DTXCID002952971-methyl-2,3-dihydro-1H-indole-5-carbaldehyde1-methyl-2,3-dihydroindole-5-carbaldehydeMFCD03208513F2189-00481-Methylindoline-5-carboxaldehyde1-Methyl-5-indolinecarbaldehyde1-Methylindoline-5-carboxaldehyde 97%
Show more names
1-methyl-5-Indolinecarboxaldehyde1-Methylindoline-5-carboxaldehyde97%2,3-Dihydro-1-methyl-1H-indole-5-carboxaldehyde1H-Indole-5-carboxaldehyde, 2,3-dihydro-1-methyl-2,3-Dihydro-1-methyl-1H-indole-5-carboxaldehyde, 5-Formyl-1-methylindoline
1-methyl-5-formylindoline5-formyl-1-methylindolineSCHEMBL6600389SCHEMBL299568351-Methyl-5-indolinecarbaldehyde #SMSSF-0017983KCA08202SBB014780
Database identifiers
- CAS
60082-02-2- PubChem CID
- 595181
- DTXSID
DTXSID30344222- EC Number
- 881-369-2
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 20.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 181
Physicochemical properties
- form
- low melting solid
- color
- Yellow to green
- InChI
- 1S/C10H11NO/c1-11-5-4-9-6-8(7-12)2-3-10(9)11/h2-3,6-7H,4-5H2,1H3
- InChIKey
- OZQGVTARHLDSTI-UHFFFAOYSA-N
- SMILES
- O=CC1=CC=C2N(C)CCC2=C1
- UNSPSC Code
- 12352200 · 12352200
- NACRES
- 21 · NA.21
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302+H312+H332-H315-H319-H335
- Precautionary statements
- 280 · P280
- WGK Germany
- 3 · WGK 3
- HS Code
- 2933998090 · 2933998090
- 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
- hs_code
- 2933998090
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Storage Class
- 11 - Combustible Solids
- Hazard statements
- H302+H312+H332-H315-H319-H335
- Precautionary statements
- P280
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers16 total
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
常州科化生物科技有限公司0519-68985668 13685222090 · [email protected]
赛默飞世尔科技（中国）有限公司800-810-5118 · [email protected]
上海安米克化学品有限公司微信 18019252918 18019252918 · [email protected]
陕西缔都医药化工有限公司+86-29-87569262 +86-15003564040 · [email protected]
九鼎化学（上海）科技有限公司4009209199 · [email protected]
HANGZHOU LEAP CHEM CO., LTD.+86-571-87711850 +86-15355479329 · [email protected]
上海睿升化工科技有限公司15026594951 · [email protected]
四川铂友生物科技有限公司（原四川佰朋）028-65791793 18140026355 · [email protected]
常州探索化学有限公司15295164949 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 19370895928 · [email protected]
南京合巨药业有限公司025-57027686 17372956142 · [email protected]
Related reactions
1 records
Compound notes
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