Basic information
- Standard SMILES
C=CC(=O)OCC(O)CC- InChIKey
NJRHMGPRPPEGQL-UHFFFAOYSA-N- Molecular formula
- C7H12O3
- Average molar mass
- 144.17 g/mol
- Monoisotopic mass
- 144.07864424
Names & identifiers
- Preferred name
- 2-Propenoic acid, 2-hydroxybutyl ester
- IUPAC
- 2-hydroxybutyl prop-2-enoate
- English name
- 2-Hydroxybutyl2-propenoate
- Molecular formula
- C7H12O3
- Molecular weight
- 144.17
Names & synonyms
2-Propenoic acid, 2-hydroxybutyl ester2421-27-4DTXSID40883718RefChem:479321DTXCID0010232152-hydroxybutyl prop-2-enoate2-hydroxybutyl acrylate2-Propenoic acid,2-hydroxybutyl esterSCHEMBL34872SCHEMBL275982702-HYDROXY BUTYL ACRYLATE1,2-Butanediol 1-acrylate
Show more names
2-Hydroxybutyl2-propenoate2-hydroxybutylprop-2-enoateAcrylic acid 2-hydroxybutyl ester2-Propenoic acid, 2-hydroxy butyl ester
Database identifiers
- CAS
2421-27-4- PubChem CID
- 102811
- DTXSID
DTXSID40883718- Nikkaji
- J175.500E
Properties
Computed structural properties
- XLogP
- 0.9
- Topological polar surface area
- 46.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 120
Physicochemical properties
- InChI
- InChI=1S/C7H12O3/c1-3-6(8)5-10-7(9)4-2/h4,6,8H,2-3,5H2,1H3
- InChIKey
- NJRHMGPRPPEGQL-UHFFFAOYSA-N
- SMILES
- C(OCC(O)CC)(=O)C=C
- EPA Substance Registry System
- 2 · 2-Propenoic acid, 2-hydroxybutyl ester (2421-27-4)
- TSCA
- TSCA listed
Safety & regulation
Hazard information
Regulatory InformationPMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.
Regulatory information
Regulatory InformationPMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing Information2-Propenoic acid, 2-hydroxybutyl ester: INACTIVE
Suppliers25 total
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
艾特（浙江）供应链管理有限公司15553101207 18615619105
广州纳珑化工有限公司13192879270; 13192879270 · [email protected]
武汉欣扬瑞和化学科技有限公司153-07155313 15307155313 · [email protected]
广东元丰化学试剂有限公司0751-2829979 13318593351 · [email protected]
武汉贝乐叶生物医药科技有限公司15871353653 18086118076 · [email protected]
广东元丰化学试剂有限公司0751-2829979 13376591640 · [email protected]
广州市康洋化工有限公司19520963397 · [email protected]
山东崇成能源科技有限公司18253333366 · [email protected]
南通市苏北化工原料有限公司0513-85290972 18762756250 · [email protected]
上海前衍生物科技有限公司02781293128 · [email protected]
海蔚化学86-21-51086038 · [email protected]
武汉麟盛科技有限公司18162769939 · [email protected]
广州尚合化学科技有限公司13352869970 13352869970 · [email protected]
湖北中隆康盛精细化工有限公司027-027-83850178 18162590268 · [email protected]
广东元丰化学试剂有限公司0751-2829979 13318584237 · [email protected]
SUZHOU SENFEIDA CHEMICAL CO.,LTD+86-0512-83500002 +86-15195660023 · [email protected]
湖北拓源精细化工有限公司027-84700466 13260688474 · [email protected]
陕西缔都医药有限责任公司81148925 17391631969 · [email protected]
广东翁江化学试剂有限公司0751-2815983 13927872582 · [email protected]
溧阳市瑞普新材料有限公司0519-18951201333 18951201333 · [email protected]
武汉青衫合源生物科技有限公司027-18327024450 18327024450 · [email protected]
博煊化学（山东）有限公司17653188518
山东项靖邦能源有限公司15550001115 15550001115 · [email protected]
南通众合化工新材料有限公司0513-85666561 15950816326 · [email protected]
Related reactions
3 records
Linked notes
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