Basic information
- CAS
22041-21-0- Standard SMILES
COC(=O)CCN1CCCC1- InChIKey
JHYKOXJKJHTKTE-UHFFFAOYSA-N- Molecular formula
- C8H15NO2
- Average molar mass
- 157.21 g/mol
- Monoisotopic mass
- 157.11027872
Names & identifiers
- Preferred name
- Methyl 3-(pyrrolidin-1-yl)propanoate
- IUPAC
- methyl 3-pyrrolidin-1-ylpropanoate
- English name
- METHYL 3-(PYRROLIDIN-1-YL)PROPANOATE
- Molecular formula
- C8H15NO2
- Molecular weight
- 157.21
Names & synonyms
methyl 3-(pyrrolidin-1-yl)propanoateRefChem:815074870-223-322041-21-0methyl 3-pyrrolidin-1-ylpropanoateMethyl 3-pyrrolidinopropionate1-Pyrrolidinepropanoic acid, methyl esterMFCD01695467Propionic acid, 3-(pyrrolidin-1-yl)-, methyl esterMethyl 1-pyrrolidinepropionateMethyl 3-(pyrrolidin-1-yl)propionate1-Pyrrolidinepropanoicacid, methyl ester
Show more names
methyl1-pyrrolidinepropionatemethyl3-(pyrrolidin-1-yl)propionate1-pyrrolidinepropionicacid,methylester1-pyrrolidinepropanoicacid,methylester3-Pyrrolizinopropionic acid methyl ester3-Pyrrolizinopropanoic acid methyl esterPyrrolidine-1-propionic acid methyl ester
BRN 0119903SCHEMBL65886DTXSID40176516JHYKOXJKJHTKTE-UHFFFAOYSA-NALBB-017871methyl 3-(1-pyrrolidinyl)propionateBBL005333STK824602
Database identifiers
- CAS
22041-21-0- PubChem CID
- 89167
- DTXSID
DTXSID40176516- EC Number
- 870-223-3
- Nikkaji
- J51.094G
Properties
Computed structural properties
- XLogP
- 0.6
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 130
Physicochemical properties
- EWG's Food Scores
- 1 · 1
- Symbol(GHS)
- 7 · GHS07,GHS05
- Signal word
- Danger
- Hazard statements
- 315 · H315-H335-H318
- Precautionary statements
- 264 · P264-P280-P302+P352-P321-P332+P313-P362-P280-P305+P351+P338-P310
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
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P332+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Safety data
- Signal word
- Danger
- Symbol(GHS)
- GHS07,GHS05
- Hazard statements
- H315-H335-H318
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362-P280-P305+P351+P338-P310
Chemistry & industry
Suppliers13 total
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
Hangzhou Sage Chemical Co., Ltd.+86057186818502 13588463833 · [email protected]
上海常丰生物医药科技有限公司+86-021-61727342 13611721451 · [email protected]
泰迩生物医药泰州有限公司052386810091 · [email protected]
常州合晶化工有限公司85528066 13775048983 · [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]
上海旺珐化工科技有限公司（安徽珐诺伊医药科技有限公司）13918479294 · [email protected]
上海琼燕医药科技有限公司086-021-15821262312 15821262312 · [email protected]
重庆卡兰医药有限公司[email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
Hefei TNJ Chemical Industry Co.,Ltd.+86-0551-65418671 +86-189 4982 3763 · [email protected]
陕西缔都化学有限公司17691182729 17392216275 · [email protected]
南京世洲生物科技有限公司025-85563444 15850508050 · [email protected]
Related reactions
1 records
Compound notes
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