Basic information
- CAS
10276-90-1- Standard SMILES
CC1Nc2ccccc2C1C- InChIKey
NNPSOAOENINXMR-UHFFFAOYSA-N- Molecular formula
- C10H13N
- Average molar mass
- 147.22 g/mol
- Monoisotopic mass
- 147.10479942
Names & identifiers
- Preferred name
- 2,3-dimethyl-2,3-dihydro-1H-indole
- IUPAC
- 2,3-dimethyl-2,3-dihydro-1H-indole
- English name
- 2,3-Dimethylindoline
- Molecular formula
- C10H13N
- Molecular weight
- 147.22
Names & synonyms
2,3-Dimethylindoline2,3-dimethyl-2,3-dihydro-1H-indoleDTXSID60908033RefChem:442475DTXCID101337120103-638-922120-50-9MFCD000057072,3-Dimethyl-2,3-dihydroindole1H-Indole, 2,3-dihydro-2,3-dimethyl-PE-1210276-90-1
Show more names
2,3-dihydro-2,3-dimethyl-1h-indolMorphinan-3,14-diol,4,5-epoxy-6-(3,6,9,12,15,18,21-heptaoxadocos-1-yloxy)-17-(2-propen-1-yl)-,(5α,6α)-,ethanedioate(1:3)(salt)
BRN 0122361INDOLINE, 2,3-DIMETHYL-2,3-dimethyl-indolin5-20-06-00396 (Beilstein Handbook Reference)SCHEMBL172934SCHEMBL6865922SCHEMBL29501187NNPSOAOENINXMR-UHFFFAOYSA-N
Database identifiers
- CAS
10276-90-1、22120-50-9- PubChem CID
- 30944
- DTXSID
DTXSID60908033- EC Number
- 103-638-9
- Nikkaji
- J1.553.063D
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 12 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 144
Physicochemical properties
- Boiling point
- 235 °C · 235 °C
- Density
- 0.987 g/cm3 · 0.987 g/cm3(Temp: 25 °C)
- storage temp.
- 2 · under inert gas (nitrogen or Argon) at 2–8 °C
- pka
- 5.31 · 5.31±0.60(Predicted)
- Appearance
- Colorless to light yellow Liquid
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 261 · P261-P305+P351+P338
- HS Code
- 2933998090 · 2933998090
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Danger
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- hs_code
- 2933998090
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
Chemistry & industry
Suppliers20 total
上海策嵘生物科技有限公司[email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
常州科化生物科技有限公司0519-68985668 13685222090 · [email protected]
天津狄克特科技有限公司22-58627059 13920586291 · [email protected]
上海智存生物科技有限公司 (上海图芃生物科技有限公司）13761914825 · [email protected]
上海寰川实业有限公司021-61478794 · [email protected]
武汉德拜技术有限公司18086626237 18086626237 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
江苏艾康生物医药研发有限公司025-66113011 19370895928 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
Shanxi Xuanran Import and Export Trade Co., Ltd.+8617735180244 · [email protected]
郑州艾克姆化工有限公司13303867194 · [email protected]
Related reactions
2 records
Compound notes
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