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Basic information
- CAS
694-55-3- Standard SMILES
CN1CC=CCC1- InChIKey
AUFIRGPROMANKW-UHFFFAOYSA-N- Molecular formula
- C6H11N
- Average molar mass
- 97.16 g/mol
- Monoisotopic mass
- 97.08914936
Names & identifiers
- Preferred name
- 1-Methyl-1,2,3,6-tetrahydropyridine
- IUPAC
- 1-methyl-3,6-dihydro-2H-pyridine
- English name
- 1-METHYL-1,2,3,6-TETRAHYDROPYRIDINE
- Molecular formula
- C6H11N
- Molecular weight
- 97.16
Names & synonyms
1-Methyl-1,2,3,6-tetrahydropyridine694-55-31,2,3,4-Tetrahydro-1-methylpyridine996Q6WT35HNSC-66490NSC-130981DTXSID10219525RefChem:1055715DTXCID60142016211-773-01-methyl-3,6-dihydro-2H-pyridinePyridine, 1,2,3,6-tetrahydro-1-methyl-
Show more names
1-Methyl-1,2,5,6-tetrahydropyridineN-Methyl-1,2,5,6-tetrahydropyridine1,2,3,6-Tetrahydro-1-methylpyridine1-Methyl-1,2,3,6-tetrahydropyridine hydrochloride,98%
1-Methyl-3-piperideine1-methyl-1,2,3,6-tetrahydro-pyridineN-Methyl-1,5,6-tetrahydropyridinePyridine,2,3,6-tetrahydro-1-methyl-NSC66490EINECS 211-773-0SCHEMBL64692SCHEMBL447204
Database identifiers
- CAS
694-55-3- PubChem CID
- 69666
- DTXSID
DTXSID10219525- UNII
- 996Q6WT35H
- EC Number
- 211-773-0
- Nikkaji
- J206.014K
Properties
Computed structural propertiesFilling in
- XLogP
- 1
- Topological polar surface area
- 3.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 7
- Formal charge
- 0
- Complexity
- 76
Physicochemical properties
- Melting point
- 198 · 198-202 °C
- Boiling point
- 112.5 °C · 112.5 °C
- Density
- 0.876 · 0.876±0.06 g/cm3(Predicted)
- pka
- 9.05 · 9.05±0.20(Predicted)
- FDA UNII
- 996 Q6WT35H · 996Q6WT35H
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
- Hazard Codes
- Xn
- Risk Statements
- 36 · 36/37/38-20/21/22
- Safety Statements
- 36 · 36/37/39-26
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
- risk_code
- 36/37/38-20/21/22
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xn
- safety_code
- 36/37/39-26
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Upstream & downstream products
Downstream products
Suppliers7 total
江苏艾康生物医药研发有限公司025-58851090 19370895928 · [email protected]
广州佳途科技股份有限公司81960175-877 18933936954 · [email protected]
Hangzhou Sage Chemical Co., Ltd.+86057186818502 13588463833 · [email protected]
泰州市众致生物科技有限公司[email protected] 15066129350 · [email protected]
赛纳斯特化学（欢迎点击联系）021-60343070
成都市汇成亨科技有限公司13521208972 639436996; 13521208972 · [email protected]
卡托研究化学公司+86-020-81960175-877 4000-868-328;4000-868-328 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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