Basic information
- CAS
41720-98-3- Standard SMILES
C[C@@H]1CCCN1- InChIKey
RGHPCLZJAFCTIK-RXMQYKEDSA-N- Molecular formula
- C5H11N
- Average molar mass
- 85.15 g/mol
- Monoisotopic mass
- 85.08914935
Overview
(R)-2-methylpyrrolidine is a 2-methylpyrrolidine that has (R)-configuration. It is a conjugate base of a (R)-2-methylpyrrolidinium.
Names & identifiers
- Preferred name
- (R)-2-Methylpyrrolidine
- IUPAC
- (2R)-2-methylpyrrolidine
- English name
- (R)-2-Methyl-pyrrolidine
- Molecular formula
- C5H11N
- Molecular weight
- 85.15
Names & synonyms
(R)-2-METHYLPYRROLIDINE41720-98-3(2R)-2-methylpyrrolidineDTXSID30348927CHEBI:78858RefChem:70246DTXCID20299999(R)-2-Methyl-pyrrolidine(R)-(-)-2-MethylpyrrolidineMFCD077830262-Methylpyrrolidine #2-(R)-methyl-pyrrolidine
Show more names
C-3166RD-2-METHYLPYRROLIDINEMethylpyrrolidine hclMETHYLPYRROLIDINE(S-2-)(2R)-2-Methylpyrrolidine hclPyrrolidine, 2-methyl-, (2R)-(R)-(?)-2-Methylpyrrolidine
2-(R)-METHYLPYRROLIDINEPS-9365C20809(r)-2-methyl pyrrolidine(2R)-(-)-2-Methyltetrahydropyrrole(2R)-(-)-2-Methyl-1-azacyclopentane(2R)-(-)-2-METHYLPYRROLIDINEA6864
Database identifiers
- CAS
41720-98-3- PubChem CID
- 641544
- DTXSID
DTXSID30348927- ChEBI
CHEBI:78858- EC Number
- 609-954-8
Properties
Computed structural properties
- XLogP
- 0.7
- Topological polar surface area
- 12 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 6
- Formal charge
- 0
- Complexity
- 43.2
Physicochemical properties
- Boiling point
- 94 °C · 94 °C(Press: 728 Torr)
- Density
- 0.842 · 0.842
- refractive index
- 1.4353 · 1.4353
- Flash point
- 45 · 45 ºF
- storage temp.
- 2 · 2-8°C
- pka
- 10.93 · 10.93±0.10(Predicted)
- form
- oil
- color
- Colourless to pale yellow
- Water Solubility
- Insoluble in water.
- InChI
- InChI=1S/C5H11N/c1-5-3-2-4-6-5/h5-6H,2-4H2,1H3/t5-/m1/s1
- InChIKey
- RGHPCLZJAFCTIK-RXMQYKEDSA-N
- SMILES
- N1CCC[C@H]1C
- CAS DataBase Reference
- 41720 · 41720-98-3(CAS DataBase Reference)
- UNSPSC Code
- 12352005 · 12352005
- NACRES
- 22 · NA.22
- Symbol(GHS)
- 2 · GHS02,GHS05,GHS07
- Signal word
Safety & regulation
GHS classification
GHS Classification
Danger
H225 (100%): Highly Flammable liquid and vapor [Danger Flammable liquids]
P210, P233, P240, P241, P242, P243, P260, P264, P270, P280, P301+P317, P301+P330+P331, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P321, P330, P363, P370+P378, P403+P235, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 41 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesFlam. Liq. 2 (100%)
Safety data
- PPE
- Faceshields, Gloves, Goggles, type ABEK (EN14387) respirator filter
- wgk
- 3
- ridadr
- UN 2924
- hs_code
- 29339900
- risk_code
- 11-22-34
- Signal word
- Danger
- Symbol(GHS)
- GHS02,GHS05,GHS07
- hazard_code
- C,F
- hazard_note
- Corrosive/Highly Flammable
- safety_code
- 26-36/37/39-45
- hazard_class
- 3
- Storage Class
- 3 - Flammable liquids
- packing_group
- Ⅱ
- Hazard statements
- H225-H302-H314
- Limited Quantities
- 1.0 L (0.3 gallon) (liquid)
- Excepted Quantities
- Max Inner Pack (30g or 30ml) and Max Outer Pack (500g or 500ml)
Chemistry & industry
Applications
UsesIt is used as a building block used in a multikilogram synthesis of a chiral naphthalenoid histamine receptor antagonist.
Upstream & downstream products
Upstream raw materials
Suppliers100 total
郑州阿尔法化工有限公司+86-18530059196 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
陕西缔都新材料有限公司81124267 17392282731 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
武汉欣扬瑞和化学科技有限公司153-07155313 15307155313 · [email protected]
温州共赢化学有限公司+86-0086-577-64498589 +86-15355981851 · [email protected]
Related reactions
61 records
Compound notes
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