1-Methylpyrrolidine-3-carboxylic acid

HCID 322598

Basic information

CAS
25712-60-1
Standard SMILES
CN1CCC(C(=O)O)C1
InChIKey
LJGFIWDOHOWUOY-UHFFFAOYSA-N
Molecular formula
C6H11NO2
Average molar mass
129.16 g/mol
Monoisotopic mass
129.07897859

Names & identifiers

Preferred name
1-Methylpyrrolidine-3-carboxylic acid
IUPAC
1-methylpyrrolidine-3-carboxylic acid
English name
1-METHYLPYRROLIDINE-3-CARBOXYLIC ACID
Molecular formula
C6H11NO2
Molecular weight
129.16

Names & synonyms

1-methylpyrrolidine-3-carboxylic acid25712-60-1DTXSID40948593RefChem:1055895DTXCID40882706412281-11-91-METHYL-PYRROLIDINE-3-CARBOXYLIC ACIDACHYRANTHINE1-methyl-3-pyrrolidinecarboxylic acidMFCD090552213-Pyrrolidinecarboxylicacid, 1-methyl-NSC280668
Show more names
N-Methyl-pyrrolidin-2-nitrilN-methylpyrrolidine-3-carboxylic acid1-Methylpyrrolidine-3-carboxylic acid hcl
3-Pyrrolidinecarboxylic acid,SCHEMBL992118SCHEMBL1361544LJGFIWDOHOWUOY-UHFFFAOYSA-NALBB-004694STK503284AKOS005171214CCG-210351

Database identifiers

CAS
25712-60-1
PubChem CID
322598
DTXSID
DTXSID40948593
Nikkaji
J2.361.885K

Properties

Computed structural properties

XLogP
-2.4
Topological polar surface area
40.5 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
1
Heavy atoms
9

Physicochemical properties

Boiling point
227 ℃ · 227℃
Density
1.153 · 1.153
Flash point
91 ℃ · 91℃
storage temp.
2 · Storage temp. 2-8°C
pka
3.53 · 3.53±0.20(Predicted)
Appearance
Off-white to light yellow Solid

Chemistry & industry

Upstream & downstream products

Suppliers33 total

广州诚创生物科技有限公司18027266590 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
苏州启航生物科技有限公司18151111370 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]

Related reactions

1 records

Compound notes

Loading…