Basic information
- CAS
2208-08-4- Standard SMILES
CCCC(=[NH2+])OCC.[Cl-]- InChIKey
YGBFFMMKLWVKGU-UHFFFAOYSA-N- Molecular formula
- C6H14ClNO
- Average molar mass
- 151.63 g/mol
- Monoisotopic mass
- 151.0763918
Names & identifiers
- Preferred name
- Butyrimidic acid, ethyl ester, hydrochloride
- IUPAC
- 1-ethoxybutylideneazanium chloride
- English name
- Ethyl butyrimidate hydrochloride
- Molecular formula
- C6H14ClNO
- Molecular weight
- 151.63446
Names & synonyms
BUTYRIMIDIC ACID, ETHYL ESTER, HYDROCHLORIDEButanimidic acid, ethyl ester, hydrochlorideNSC 97334AI3-51437RefChem:571895629-535-31-ethoxybutylideneazanium;chlorideCrisaborole Impurity 96ethyl butanimidate hydrochlorideTelmisartan Impurity 55 Hydrochlorideethyl butanecarboximidate hydrochloridebutyrimidicacid,ethylester,hydrochloride
Show more names
Ethyl butyrimidate hydrochloride >=97.0% (AT)
Database identifiers
- CAS
2208-08-4- PubChem CID
- 16633
Properties
Computed structural properties
- Topological polar surface area
- 34.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 70.9
Physicochemical properties
- Melting point
- 74 · 74-79 °C
- storage temp.
- 2 · 2-8°C
- BRN
- 3679641 · 3679641
- InChI
- 1S/C6H13NO.ClH/c1-3-5-6(7)8-4-2;/h7H,3-5H2,1-2H3;1H
- InChIKey
- YGBFFMMKLWVKGU-UHFFFAOYSA-N
- SMILES
- Cl.CCCC(=N)OCC
- UNSPSC Code
- 12352100 · 12352100
- NACRES
- 22 · NA.22
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 261 · P261-P305+P351+P338
- target organs
- Respiratory system
- PPE
- 95 · dust mask type N95 (US), Eyeshields, Gloves
- Hazard Codes
- Xi
- Risk Statements
- 36 · 36/37/38
- Safety Statements
- 26 · 26-36
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
- F
- 3-10-21
- PPE
- dust mask type N95 (US), Eyeshields, Gloves
- wgk
- 3
- rtecs
- ET7250000
- risk_code
- 36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- safety_code
- 26-36
- Storage Class
- 11 - Combustible Solids
- target organs
- Respiratory system
- Hazard statements
- H315-H319-H335
- Hazard Classifications
- Eye Irrit. 2Skin Irrit. 2STOT SE 3
- Precautionary statements
- P261-P305+P351+P338
Chemistry & industry
Suppliers14 total
重庆欣博曜生物科技有限公司19122915778 · [email protected]
Aladdin Scientific[email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
山东沃德森生物科技有限公司0531-88723173 18596073690 · [email protected]
HBCChem, Inc.+1-510-219-6317 · [email protected]
Sigma-Aldrich西格玛奥德里奇(上海)贸易有限公司021-61415566 800-8193336 · [email protected]
深圳振强药物研发有限公司+86-0755-66853366 +86-13670046396 · [email protected]
上海阿拉丁生化科技股份有限公司6206333 13167063860 · [email protected]
上海百韧生物科技有限公司13564638271 · [email protected]
湖北扬信医药科技有限公司15374522761 · [email protected]
江苏艾康生物医药研发有限公司025-66061636 19370895928 · [email protected]
河南奥诗曼生物科技有限公司13761588971 17719817155 · [email protected]
陕西缔都医药有限责任公司81148925 17391631969 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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