Basic information
- Standard SMILES
Cl.NCc1ccc(S(N)(=O)=O)cc1- InChIKey
SIACJRVYIPXFKS-UHFFFAOYSA-N- Molecular formula
- C7H11ClN2O2S
- Average molar mass
- 222.69 g/mol
- Monoisotopic mass
- 222.02297627
Overview
See also: Mafenide (has active moiety).
Names & identifiers
- Preferred name
- Mafenide Hydrochloride
- IUPAC
- 4-(aminomethyl)benzenesulfonamide;hydrochloride
- English name
- Mafenide hydrochloride
- Molecular formula
- C7H11ClN2O2S
- Molecular weight
- 222.69
Names & synonyms
Mafenide hydrochloride138-37-44-Aminomethylbenzenesulfonamide hydrochloride4-(Aminomethyl)benzenesulfonamide hydrochlorideHomosulfamine hydrochlorideMafenide HClMorfanilMasudinMesudin hydrochlorideAmbamide hydrochloride4-Homosulfanilamide hydrochlorideEmilene hydrochloride
Show more names
MAFENIDEMARFANILMAFENIDEHCLLABOTEST-BB LT00454465LABOTEST-BB LTBB000725MARFANIL HYDROCHLORIDEsulfamylonhydrochloride
Sulfamylon hydrochlorideSulfbenzamine hydrochlorideMesudrin hydrochlorideNeofamid hydrochlorideMaphenide hydrochlorideHomosulfanilamide hydrochlorideBenzenesulfonamide, 4-(aminomethyl)-, monohydrochlorideDTXSID6045296
Database identifiers
- CAS
138-37-4、49783-80-4- PubChem CID
- 67313
- DTXSID
DTXSID6045296- ChEMBL
CHEMBL1593568- UNII
- 3J751V0284
- EC Number
- 205-325-3
Properties
Computed structural properties
- Topological polar surface area
- 94.6 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 224
Experimental & physicochemical properties
DrugsPharmaceuticals -> Antibiotics
Physicochemical properties
- Melting point
- 261 · 261-263 °C(lit.)
- storage temp.
- Inert atmosphere,Room Temperature
- solubility
- DMSO (Slightly), Methanol (Slightly)
- form
- Solid
- color
- White
- Merck
- 13 · 13,5671
- Major Application
- forensics and toxicologypharmaceutical (small molecule)
- Cosmetics Ingredients Functions
- ANTIMICROBIAL
- InChI
- InChI=1S/C7H10N2O2S.ClH/c8-5-6-1-3-7(4-2-6)12(9,10)11;/h1-4H,5,8H2,(H2,9,10,11);1H
- InChIKey
- SIACJRVYIPXFKS-UHFFFAOYSA-N
- SMILES
- C1(S(=O)(=O)N)=CC=C(CN)C=C1.Cl
- CAS DataBase Reference
- 138 · 138-37-4(CAS DataBase Reference)
- FDA UNII
- 3 J751V0284 · 3J751V0284
- UNSPSC Code
- 41116107 · 41116107
- NACRES
- 24 · NA.24
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 317 · H317
- Precautionary statements
- 280 · P280
- PPE
- 95 · dust mask type N95 (US), Eyeshields, Faceshields, Gloves
- Hazard Codes
- Xn
- Risk Statements
- 42 · 42/43
- Safety Statements
- 22 · 22-36/37-45
- WGK Germany
- 2 · 2
- RTECS
- 5425000 · XT5425000
- HS Code
- 29350090 · 29350090
- Storage Class
- 11 · 11 - Combustible Solids
- Hazard Classifications
- 1 · Skin Sens. 1
- Toxicity
- 50 in · LD50 in rats, mice (mg/kg): 1170, 900 i.v. (Skulan, Hoppe)
Safety & regulation
GHS classification
GHS Classification
Warning
H317 (100%): May cause an allergic skin reaction [Warning Sensitization, Skin]
P261, P272, P280, P302+P352, P321, P333+P317, P362+P364, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 1 notifications to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesSkin Sens. 1 (100%)
Safety data
- PPE
- dust mask type N95 (US), Eyeshields, Faceshields, Gloves
- wgk
- 2
- rtecs
- XT5425000
- hs_code
- 29350090
- Toxicity
- LD50 in rats, mice (mg/kg): 1170, 900 i.v. (Skulan, Hoppe)
- risk_code
- 42/43
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xn
- safety_code
- 22-36/37-45
- Storage Class
- 11 - Combustible Solids
- Hazard statements
- H317
- Hazard Classifications
- Skin Sens. 1
- Precautionary statements
- P280
Chemistry & industry
Applications
UsesAntibacterial;Inhibitor of folic acid biosynthesis
Upstream & downstream products
Upstream raw materials
Suppliers50 total
北京华美互利生物化工010-56205725 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
衢州润东化工有限公司0570-8789886 18892685668 · [email protected]
湖北永阔科技有限公司027-59223108 15972152991 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
Shandong chuangyingchemical Co., Ltd.18853181302 · [email protected]
武汉英诺医药科技有限公司+86-027-59232304 15387063101 · [email protected]
艾吉析科技(上海)有限公司17717235263 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
咸宁深蓝生物医药研发有限公司18171815831 · [email protected]
河南多贝化工有限公司0370-6999054 17550096163 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
上海遐瑞医药科技有限公司+86-021-61551413 · [email protected]
河北创海生物科技有限公司+86-86-13131129325 · [email protected]
T&W GROUP021-61551611 13296011611 · [email protected]
湖北科乐精细化工有限公司027-59101668 19945030958 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
韶远科技(上海)有限公司021-50795510 4000665055 · [email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
北京华威锐科化工有限公司0757-86329057 18934348241 · [email protected]
湖北威德利化学试剂有限公司17771473825 13385289472 · [email protected]
江西瑞威尔生物科技有限公司18502762009 · [email protected]
安耐吉化学&3A(安徽泽升科技股份有限公司)400-0056266 · [email protected]
MedBio脉铂医药021-69568360 18916172912 · [email protected]
上海相辉医药科技有限公司13761987713 · [email protected]
上海泰坦科技股份有限公司400-6009262 15618770481 · [email protected]
MedChemexpress LLC021-58955995 · [email protected]
BOC Sciences1-631-485-4226; 16314854226 · [email protected]
孝感深远化工有限公司15527621225; 15527621225 · [email protected]
ChemeGen 中国18818260767 · [email protected]
玛雅试剂+86 (573) 82222445 (0)18006601000 452520369 · [email protected]
四川库利南科技有限公司400-1166-196 18981987031 · [email protected]
TCI AMERICA800-4238616 · [email protected]
TOKYO CHEMICAL INDUSTRY CO., LTD.03-36680489 · [email protected]
TCI Europe320-37350700 · [email protected]
武汉普洛夫生物科技有限公司17612776928 · [email protected]
上海将来实业股份有限公司400-0066400 13621662912 · [email protected]
Labnetwork lnc.+86-27-50766799 +86-18062016861 · [email protected]
成都零六生物科技有限公司400-1166-196 13458535857 · [email protected]
湖南华腾制药有限公司400-8592883 · [email protected]
上海寰川实业有限公司021-61478794 · [email protected]
池州凯隆进出口贸易有限公司[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]
天津阿尔塔科技有限公司022-6537-8550 15522853686 · [email protected]
TargetMol中国(陶术生物)021-021-33632979 15002134094 · [email protected]
上海昕凯医药科技有限公司21-619849051-1 18521059765 · [email protected]
上海陶术生物科技股份有限公司+1-781-999-5354; +1-00000000000 · [email protected]
上海波以尔化工有限公司021-50182298 021-50180596 · [email protected]
九鼎化学(上海)科技有限公司4009209199 · [email protected]
武汉鑫儒化工有限公司15927387915 15337108568
Related reactions
24 records
Linked notes
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