Basic information
- CAS
87602-66-2- Standard SMILES
Cc1cc(C)c2nc(C)cc(Cl)c2c1- InChIKey
FGGSFRDVXDCVEI-UHFFFAOYSA-N- Molecular formula
- C12H12ClN
- Average molar mass
- 205.68 g/mol
- Monoisotopic mass
- 205.0658271
Names & identifiers
- Preferred name
- 4-Chloro-2,6,8-trimethylquinoline
- IUPAC
- 4-chloro-2,6,8-trimethylquinoline
- English name
- AURORA 19332
- Molecular formula
- C12H12ClN
- Molecular weight
- 205.68
Names & synonyms
4-chloro-2,6,8-trimethylquinoline87602-66-2AURORA 19332MFCD03622363SCHEMBL17502194WLZ40152,6,8-trimethyl-4-chloroquinolineAKOS002350436AB15608DB-212690CS-0313847ST50198118
Show more names
OTAVA-BB 7013980582OTAVA-BB BB70139805824-CHLORO-2,6,8-TRIMETHYL-QUINOLINEQuinoline, 4-chloro-2,6,8-trimethyl-
G786274-Chloro-2,6,8-trimethylquinoline, AldrichCPRF720883F3098-4129
Database identifiers
- CAS
87602-66-2- PubChem CID
- 732017
- EC Number
- 809-675-3
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 12.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 206
Physicochemical properties
- form
- solid
- InChI
- 1S/C12H12ClN/c1-7-4-8(2)12-10(5-7)11(13)6-9(3)14-12/h4-6H,1-3H3
- InChIKey
- FGGSFRDVXDCVEI-UHFFFAOYSA-N
- SMILES
- Cc1cc(C)c2nc(C)cc(Cl)c2c1
- UNSPSC Code
- 12352200 · 12352200
- NACRES
- 21 · NA.21
- Symbol(GHS)
- 6 · GHS06
- Signal word
- Danger
- Hazard statements
- 301 · H301-H413
- Precautionary statements
- 301 · P301+P310
- Hazard Codes
- T
- Risk Statements
- 25 · 25
- Safety Statements
- 45 · 45
- RIDADR
- 2811 · UN 2811 6.1 / PGIII
- WGK Germany
- 3 · 3
- HS Code
- 2933499090 · 2933499090
- Storage Class
- 6.1 C · 6.1C - Combustible acute toxic Cat.3toxic compounds or compounds which causing chronic effects
- Hazard Classifications
- 3 OralAquatic · Acute Tox. 3 OralAquatic Chronic 4
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
H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]
P264, P270, P273, P301+P316, P321, P330, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 38 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAcute Tox. 3 (100%)
Safety data
- wgk
- 3
- ridadr
- UN 2811 6.1 / PGIII
- hs_code
- 2933499090
- risk_code
- 25
- Signal word
- Danger
- Symbol(GHS)
- GHS06
- hazard_code
- T
- safety_code
- 45
- Storage Class
- 6.1C - Combustible acute toxic Cat.3toxic compounds or compounds which causing chronic effects
- Hazard statements
- H301-H413
- Hazard Classifications
- Acute Tox. 3 OralAquatic Chronic 4
- Precautionary statements
- P301+P310
Chemistry & industry
Suppliers13 total
南京波普生物医药研发有限公司025-87138562 18951783565 · [email protected]
合肥翰刚医药科技有限公司+8618062405514 · [email protected]
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
Aladdin Scientific[email protected]
江苏艾康生物医药研发有限公司025-5885952 15955137747 · [email protected]
烟台盛凯伦生物制品有限公司13356901049 · [email protected]
HONG KONG IPURE BIOLOGY CO.,LIMITED86 18062405514 18062405514 · [email protected]
南京诺利斯医药科技有限公司13901585132 · [email protected]
上海阿拉丁生化科技股份有限公司6206333 13167063860 · [email protected]
烟台盛凯伦化学科技有限公司13356901049 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
合肥钼凯医药科技有限公司18001872185; 18001872185 · [email protected]
Nanjing Bicbiotechnology Co., Ltd+86-2552131256 +86-18251840740 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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