Basic information
- CAS
78584-33-5- Standard SMILES
COC(=O)C#Cc1ccncc1- InChIKey
VLLKKRYTNVEEMD-UHFFFAOYSA-N- Molecular formula
- C9H7NO2
- Average molar mass
- 161.16 g/mol
Names & identifiers
- Preferred name
- Methyl 3-(4-Pyridyl)propiolate
- IUPAC
- methyl 3-pyridin-4-ylprop-2-ynoate
- English name
- Methyl 3-(pyridin-4-yl)propiolate
- Molecular formula
- C9H7NO2
- Molecular weight
- 161.16
Names & synonyms
Methyl 3-(4-Pyridyl)propiolate78584-33-5Methyl 3-(pyridin-4-yl)propiolatemethyl 3-(pyridin-4-yl)prop-2-ynoateMFCD18205099methyl 3-pyridin-4-ylprop-2-ynoateMethyl3-(4-Pyridyl)propiolatemethyl 3-(4-pyridyl)prop-2-ynoateAC6823AKOS013859248SY022412DB-230716
Show more names
(pyridyl-4)propiolate de methyle2-Propynoic acid, 3-(4-pyridinyl)-, methyl ester
CS-0301811EN300-787185F8885-5839
Database identifiers
- CAS
78584-33-5
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 39.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 217
Physicochemical properties
- HS Code
- 2933399990 · 2933399990
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- hs_code
- 2933399990
Chemistry & industry
Upstream & downstream products
Downstream products
Suppliers9 total
韶远科技(上海)有限公司4000665055 · [email protected]
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
上海拉曼达医药科技有限公司021-19921844 19921844785 · [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]
华诺医药科技(广西)有限公司13005928603 · [email protected]
江苏艾康生物医药研发有限公司025-66113011 19370895928 · [email protected]
上海琼燕医药科技有限公司086-021-15821262312 15821262312 · [email protected]
Accela ChemBio Inc.+1-858-6993322 +86-18019713315 · [email protected]
SHANGHAI YOUNG-CHEM CHEMICAL CO., LTD.13817489192 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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