Basic information
- CAS
36194-82-8- Standard SMILES
Cc1cc(Br)cc(C(=O)O)c1O- InChIKey
YMYKOYICVWKQFQ-UHFFFAOYSA-N- Molecular formula
- C8H7BrO3
- Average molar mass
- 231.04 g/mol
- Monoisotopic mass
- 229.95786
Names & identifiers
- Preferred name
- 5-Bromo-2-hydroxy-3-methylbenzoic acid
- IUPAC
- 5-bromo-2-hydroxy-3-methylbenzoic acid
- English name
- 5-Bromo-2-hydroxy-3-methylbenzenecarboxylic acid
- Molecular formula
- C8H7BrO3
- Molecular weight
- 231.04
Names & synonyms
5-bromo-2-hydroxy-3-methylbenzoic acid36194-82-8DTXSID30377414RefChem:301666DTXCID90328442630-005-95-Bromo-2-hydroxy-3-methylbenzenecarboxylic acidMFCD000932695-bromo-2-hydroxy-3-methyl-benzoic Acid5-bromo-2-hydroxy-3-methylbenzoate5-Bromo-3-methylsalicylic acid5-BROMO-2-HYDROXY-3-METHYLBENZENECARBOXYLICACID
Show more names
5-Bromo-2-hydroxy-3-methylbenzoic acid 98%5-Bromo-3-methylsalicylic acid, 5-Bromo-2-hydroxy-m-toluic acid
Benzoic acid, 5-bromo-2-hydroxy-3-methyl-SCHEMBL2468352YMYKOYICVWKQFQ-UHFFFAOYSA-NBBL035884CL9415SBB097694STL4443855-bromo-2-hydroxy-3-methylbenzoicacid
Database identifiers
- CAS
36194-82-8- PubChem CID
- 2764345
- DTXSID
DTXSID30377414- EC Number
- 630-005-9
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 57.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 183
Physicochemical properties
- Melting point
- 231 · 231-234
- storage temp.
- Inert atmosphere,Room Temperature
- form
- solid
- color
- White
- InChI
- InChI=1S/C8H7BrO3/c1-4-2-5(9)3-6(7(4)10)8(11)12/h2-3,10H,1H3,(H,11,12)
- InChIKey
- YMYKOYICVWKQFQ-UHFFFAOYSA-N
- SMILES
- C(O)(=O)C1=CC(Br)=CC(C)=C1O
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302
- Precautionary statements
- 280 · P280-P305+P351+P338
- Hazard Codes
- Xi,Xn
- Risk Statements
- 22 · 22
- HazardClass
- IRRITANT
- HS Code
- 2918199890 · 2918199890
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]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract 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)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)；Eye Irrit. 2 (100%)；STOT SE 3 (100%)
Safety data
- hs_code
- 2918199890
- risk_code
- 22
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi,Xn
- hazard_class
- IRRITANT
- Hazard statements
- H302
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Suppliers41 total
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
温州共赢化学有限公司+86-0086-577-64498589 +86-15355981851 · [email protected]
陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]
安徽合诺生物科技有限公司0555-2761852
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [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]
武汉凯威斯科技有限公司86-027-67849912 · [email protected]
江苏药恒医药科技有限公司13524761129 · [email protected]
常州科化生物科技有限公司0519-68985668 13685222090 · [email protected]
上海瀚鸿科技股份有限公司021-54306202 13764082696 · [email protected]
安徽合诺生物科技有限公司18455579438
Aceschem Inc.+1-817863-6948 +1-（817）863-6948 · [email protected]
天津佶品佳化工科技有限公司18622448868 · [email protected]
江苏艾康生物医药研发有限公司025-66113011 13913916777 · [email protected]
上海裕兰生物科技有限公司021-57171705 13817537615 · [email protected]
PT CHEM GROUP LIMITED+86-85511178; +86-85511178 · [email protected]
河北朵放科技有限公司13127301785 · [email protected]
普善实业（陕西）有限公司029-81310890 18165209495 · [email protected]
北京禾兴源科技有限公司18511709189 · [email protected]
衢州爱美康生物科技有限公司0570-3081766 18357083060 · [email protected]
Guangzhou Yuheng Pharmaceutical Technology Co., Ltd+8613580539051 · [email protected]
杭州洁汉化工有限公司+86-571-86217390; +8618058761490 · [email protected]
河南奥诗曼生物科技有限公司13761588971 17719817155 · [email protected]
上海吉至生化科技有限公司021-4009004166/18616739031 18616739031 · [email protected]
Changzhou Ansciep Chemical Co., Ltd.+86 519 86305871 · [email protected]
徐州砥研医药科技有限公司0516-0516-88997009 18651776937 · [email protected]
常州千艾生物科技有限公司051915240519135 13961152745 · [email protected]
上海肯恩化学科技有限公司13701870891; 02152215958 · [email protected]
Alchem Pharmtech,Inc.8485655694 · [email protected]
合肥钼凯医药科技有限公司18130062233 · [email protected]
陕西国槐硕海医药科技有限公司029-13279368192 13279368192 · [email protected]
Capot Chemical Co., Ltd+86 (0) 571 85 58 67 18
上海捷世凯生物科技有限公司021-57520305 13795461237 · [email protected]
重庆卡兰医药有限公司[email protected]
上海相辉医药科技有限公司13611835272 13611835272 · [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]
Hefei TNJ Chemical Industry Co.,Ltd.+86-0551-65418671 +86-189 4982 3763 · [email protected]
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
河南威梯希化工科技有限公司0371-55135753 18003832934 · [email protected]
Related reactions
4 records
Compound notes
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