Basic information
- CAS
16277-06-8- Standard SMILES
CC1(C(=O)O)CCCN1- InChIKey
LWHHAVWYGIBIEU-UHFFFAOYSA-N- Molecular formula
- C6H11NO2
- Average molar mass
- 129.16 g/mol
- Monoisotopic mass
- 129.07897859
Names & identifiers
- Preferred name
- 2-Methylpyrrolidine-2-carboxylic acid
- IUPAC
- 2-methylpyrrolidine-2-carboxylic acid
- English name
- Proline, 2-methyl- (9CI)
- Molecular formula
- C6H11NO2
- Molecular weight
- 129.16
Names & synonyms
2-methylpyrrolidine-2-carboxylic acid16277-06-8(R) - 2-methylproline(S)-2-Methyl-2-pyrrolidinecarboxylicacidNSC-14964d-a-methylprolineL-a-methylproline2-Methylproline #2-METHYL-DL-PROLINESCHEMBL573927SCHEMBL1770504LWHHAVWYGIBIEU-UHFFFAOYSA-N
Show more names
α-methylprolineProline, 2-methyl-2-Methyl-DL-proline HClProline, 2-methyl- (9CI)2-methylproline(SALTDATA: HCl)
ALBB-038248NSC149642-methylpyrrolidine-2-carboxylicacidAKOS0062786762-Methyl-pyrrolidine-2-carboxylic acidPD196072DB-116879NS00123328
Database identifiers
- CAS
16277-06-8、42856-71-3- PubChem CID
- 95491
- EC Number
- 804-948-3
Properties
Computed structural properties
- XLogP
- -2.2
- Topological polar surface area
- 49.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 135
Physicochemical properties
- Boiling point
- 241.9 · 241.9±33.0 °C(Predicted)
- Density
- 1.119 · 1.119±0.06 g/cm3(Predicted)
- storage temp.
- Store at Room Tem.
- pka
- 2.44 · 2.44±0.20(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 264 · P264-P280-P302+P352-P321-P332+P313-P362-P305+P351+P338-P337+P313-P261-P271-P304+P340-P312-P403+P233-P405-P501
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
This chemical does not meet GHS hazard criteria for 100% (2 of 2) of all reports.
Not Classified
Aggregated GHS information provided per 2 reports by companies from 1 notifications to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesNot Classified
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362-P305+P351+P338-P337+P313-P261-P271-P304+P340-P312-P403+P233-P405-P501
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers9 total
梯希爱（上海）化工贸易有限公司021-61109150 · [email protected]
sgtlifesciences pvt ltd+91-8790379245 · [email protected]
苏州爱玛特生物科技有限公司0512-56316828 400-867-5858;400-867-5858 · [email protected]
北京珐默兹医药科技有限公司15811073878 · [email protected]
济南尚博医药股份有限公司0531-61320525 15866703830 · [email protected]
济南尚博生物科技有限公司+8615866703830 · [email protected]
滨海吉尔多肽有限公司021-61263389 13524856427 · [email protected]
江苏洪珉药业有限公司18221292452 · [email protected]
Nextpeptide Inc+86-0571-81612335 +8613336028439 · [email protected]
Related reactions
2 records
Compound notes
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