Basic information
- CAS
82817-65-0- Standard SMILES
CC(=O)Nc1cncc(C(=O)O)c1- InChIKey
KMRQIJRSLWWZAM-UHFFFAOYSA-N- Molecular formula
- C8H8N2O3
- Average molar mass
- 180.16 g/mol
- Monoisotopic mass
- 180.05349212
Names & identifiers
- Preferred name
- 5-Acetamidonicotinic acid
- IUPAC
- 5-acetamidopyridine-3-carboxylic acid
- English name
- 5-ACETAMIDONICOTINIC ACID
- Molecular formula
- C8H8N2O3
- Molecular weight
- 180.16
Names & synonyms
5-Acetamidonicotinic acid82817-65-05-acetamidopyridine-3-carboxylic acidMFCD04115723NSC606897SCHEMBL185842SCHEMBL31015916DTXSID50326641AKOS010054438AB20472NSC-606897PS-6213
Show more names
5-Acetamidonic acid5-Acetamidonicotinic acid 98%5-Acetamidonicotinic acid ,98%5-ACETAMIDO-3-PYRIDINECARBOXYLIC ACID5-(acetylamino)pyridine-3-carboxylic acid3-Pyridinecarboxylic acid, 5-(acetylamino)-
SY064925CS-0092040EN300-148799F81458F209830
Database identifiers
- CAS
82817-65-0- PubChem CID
- 354633
- DTXSID
DTXSID50326641
Properties
Computed structural properties
- XLogP
- -0.4
- Topological polar surface area
- 79.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 217
Physicochemical properties
- Melting point
- 292 · 292-294
- storage temp.
- 2 · Sealed in dry,2-8°C
- form
- solid
- color
- Off-white
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P301+P312-P302+P352-P304+P340-P305+P351+P338
- Hazard Codes
- Xi
- Risk Statements
- 36 · 36/37/38
- Safety Statements
- 26 · 26-37/39
- Hazard Note
- Irritant/Keep Cold
- HS Code
- 29333990 · 29333990
Safety & regulation
Safety data
- hs_code
- 29333990
- risk_code
- 36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- hazard_note
- Irritant/Keep Cold
- safety_code
- 26-37/39
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P301+P312-P302+P352-P304+P340-P305+P351+P338
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers30 total
Hebei Chuanghai Biotechnology Co., Ltd+86-17732866630 · [email protected]
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [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]
武汉凯威斯科技有限公司86-027-67849912 · [email protected]
常州科化生物科技有限公司0519-68985668 13685222090 · [email protected]
吉林中科研伸科技有限公司18143011203 · [email protected]
山东西亚化学有限公司13355009207 13355009207 · [email protected]
江苏艾康生物医药研发有限公司025-66113011 13913916777 · [email protected]
上海贤鼎生物科技有限公司4009209199 · [email protected]
成都零六生物科技有限公司400-1166-196 13458535857 · [email protected]
南京深界智连科技有限公司15026684954 · [email protected]
上海阿拉丁生化科技股份有限公司6206333 13167063860 · [email protected]
武汉凯威斯科技有限公司027-67849912 · [email protected]
上海源叶生物科技有限公司13636370518 · [email protected]
大连金点生物科技有限公司0411-0411-00000000 13644282108 · [email protected]
河南威梯希化工科技有限公司0371-53732842 13383863444 · [email protected]
深圳聚合生化科技有限公司+86-400-002-6226 · [email protected]
济南睿思医药技术有限公司0531-0531-69900633 19963472814 · [email protected]
上海肯恩化学科技有限公司13701870891; 02152215958 · [email protected]
ANHUI WITOP BIOTECH CO., LTD+8618071025641 · [email protected]
Alchem Pharmtech,Inc.8485655694 · [email protected]
武汉凯威斯科技有限公司027-67849912 · [email protected]
陕西缔都医药有限责任公司81148925 17391631969 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
上海祺弘医药科技有限公司13482681346 18117455885 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
烟台盛凯伦化学科技有限公司开发区第一分公司13356901049 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Hefei TNJ Chemical Industry Co.,Ltd.+86-0551-65418684 +86-18949823763 · [email protected]
Related reactions
1 records
Compound notes
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