Basic information
- CAS
636-48-6- Standard SMILES
CCC(CC(=O)O)C(=O)O- InChIKey
RVHOBHMAPRVOLO-UHFFFAOYSA-N- Molecular formula
- C6H10O4
- Average molar mass
- 146.14 g/mol
- Monoisotopic mass
- 146.0579088
Overview
2-ethylsuccinic acid is an alpha,-dicarboxylic acid that is succinic acid substituted by an ethyl group at position 2. It is functionally related to a succinic acid. It is a conjugate acid of a 2-ethylsuccinate.
Names & identifiers
- Preferred name
- 2-Ethylbutanedioic acid
- IUPAC
- 2-ethylbutanedioic acid
- English name
- 2-Ethylsuccinic acid
- Molecular formula
- C6H10O4
- Molecular weight
- 146.14
Names & synonyms
2-Ethylbutanedioic acidEthylsuccinic acidEINECS 211-259-6DTXSID70979815RefChem:471909DTXCID50835268211-259-62-ethylsuccinic acid636-48-6Ethyl succinic acidMFCD02258655Athylbernsteinsaure
Show more names
monoethylsuccinic acidalpha-ethylsuccinic acidButanedioic acid, 2-ethyl-SCHEMBL61510AKOS MSC-0138SCHEMBL293785SCHEMBL6629922CHEBI:195363
Database identifiers
- CAS
636-48-6- PubChem CID
- 69466
- DTXSID
DTXSID70979815- ChEBI
CHEBI:195363- EC Number
- 211-259-6
- Nikkaji
- J136.985G
Properties
Computed structural properties
- XLogP
- 0.1
- Topological polar surface area
- 74.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 141
Physicochemical properties
- Melting point
- 83.5 · 83.5-85 °C
- Boiling point
- 250.7 · 250.7±13.0 °C(Predicted)
- Density
- 1.246 · 1.246±0.06 g/cm3(Predicted)
- pka
- 1 · pK1:4.08(0) (25°C)
- LogP
- -0.07 · -0.070 (est)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 271 · P271-P261-P280
- Hazard Codes
- Xi
- Hazard Note
- Irritant
- HS Code
- 2917198090 · 2917198090
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
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Safety data
- hs_code
- 2917198090
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- hazard_note
- Irritant
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P271-P261-P280
Chemistry & industry
Suppliers21 total
江苏艾康生物医药研发有限公司025-58851090 19370895928 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
衢州明锋化工有限公司0570-3062502 13819002126;13819008176 · [email protected]
北京环宇世纪化学科技有限公司hysj_bj.com
上海贺康生物技术有限公司17721021104 18939837085 · [email protected]
上海创焰化学科技有限公司021-11111111 11111111111 · [email protected]
河南东元化工科技有限公司16696119288 · [email protected]
成都格里迈特医药技术有限公司17308078590; 15928855497 · [email protected]
成都卡麦尔医药科技有限公司028-67136579 15828051124 · [email protected]
常州安奈凯医药科技有限公司+86-0519-8359-8696 · [email protected]
青岛海力诺化工有限公司[email protected]
BOC Sciences[email protected]
上海康恩博医药科技有限公司（科小研试剂）400-1388-521 17510465506 · [email protected]
杭州洁汉化工有限公司+86-571-86217390; +8618058761490 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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