Basic information
- CAS
15894-70-9- Standard SMILES
N#CNC(N)=NCCCCCCN=C(N)NC#N- InChIKey
YXZZOMVBHPCKMM-UHFFFAOYSA-N- Molecular formula
- C10H18N8
- Average molar mass
- 250.3 g/mol
- Monoisotopic mass
- 250.16544261
Names & identifiers
- Preferred name
- 1,6-Di(cyanoguanidino)hexane
- IUPAC
- 2-[6-[[amino-(cyanoamino)methylidene]amino]hexyl]-1-cyanoguanidine
- English name
- 1,6-Bis(cyano-guanidino)hexane
- Molecular formula
- C10H18N8
- Molecular weight
- 250.3
Names & synonyms
RefChem:196851DTXCID50351151,6-Bis(cyanoguanidino)hexane1,6-BIS(N3-CYANO-N1-GUANIDINO)HEXANE1,6-DI(CYANOGUANIDINO)HEXANE1,6-Hexamethylenebis(dicyanamide)DTXSID2065967EC 240-032-4EINECS 240-032-4GUANIDINE, 1,1'-HEXAMETHYLENEBIS(3-CYANO-Guanidine, N,N'''-1,6-hexanediylbis(N'-cyano-Guanidine, N,N'''-1,6-hexanediylbis[N'-cyano-
Show more names
1,6-Hexamethylenebis-(dicyanamide)HMBCG1,6-Bis(cyano-guanidino)hexane1,6-Dicyanoguanidine hexane1,6-Bis(3-cyanoguanidino)hexane1,6-Bis(cyano-guanidino)-hexane1,6-Bis(cyano-guanidinol)hexane
N,N'''-1,6-HEXANEDIYLBIS(N'-CYANOGUANIDINE)N,N'''-1,6-hexanediylbis[N'-cyanoguanidine]N,N'-BIS(CYANOGUANIDINE)-1,6-HEXANEDIAMINEUNII-XDT03M5I8NXDT03M5I8N2-[6-[[amino-(cyanoamino)methylidene]amino]hexyl]-1-cyanoguanidineC10H18N8YXZZOMVBHPCKMM-UHFFFAOYSA-N
Database identifiers
- CAS
15894-70-9- PubChem CID
- 85172
- EC Number
- 240-032-4
Properties
Computed structural properties
- XLogP
- -0.5
- Topological polar surface area
- 148 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 9
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 341
Physicochemical properties
- Melting point
- 2950 C · >2950C
- Boiling point
- 370.7 · 370.7±52.0 °C(Predicted)
- Density
- 1.25 · 1.25±0.1 g/cm3(Predicted)
- vapor pressure
- 0 Pa · 0Pa at 95℃
- storage temp.
- -20 °C · Keep in dark place,Inert atmosphere,Store in freezer, under -20°C
- solubility
- DMSO (Slightly), Methanol (Very Slightly), Water (Very Slightly, Heated)
- form
- Solid
- pka
- 3.21 · 3.21±0.70(Predicted)
- color
- White to Off-White
- Water Solubility
- 7.05 mg/L · 7.05mg/L at 25℃
- InChI
- InChI=1S/C10H18N8/c11-7-17-9(13)15-5-3-1-2-4-6-16-10(14)18-8-12/h1-6H2,(H3,13,15,17)(H3,14,16,18)
- InChIKey
- YXZZOMVBHPCKMM-UHFFFAOYSA-N
- SMILES
- C(NC(=N)NC#N)CCCCCNC(=N)NC#N
- LogP
- 0.465 at · 0.465 at 23℃
- CAS DataBase Reference
- 15894 · 15894-70-9
- FDA UNII
- 3 M5I8N · XDT03M5I8N
- EPA Substance Registry System
- -1 · Guanidine, N,N'''-1,6-hexanediylbis[N'-cyano- (15894-70-9)
- Symbol(GHS)
- 9 · GHS09
- Signal word
- Warning
- Hazard statements
- 411 · H411
- Precautionary statements
- 211 · P211-P232-P233-P235-P260-P281-P301+P312-P301+P330+P331-P302+P352-P304+P340-P305+P351+P338-P309+P311
- TSCA
- TSCA listed
- REACH Registrations
- Active
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
This chemical does not meet GHS hazard criteria for 99.5% (191 of 192) of all reports.
Not Classified
Aggregated GHS information provided per 192 reports by companies from 2 notifications to the ECHA C&L Inventory.
Hazard information
Regulatory Information
Chemical: Guanidine, N,N'''-1,6-hexanediylbis[N'-cyano-
REACH registered substance: N,N'''-1,6-hexanediylbis[N'-cyanoguanidine] (EC: 240-032-4)
Guanidine, N,N'''-1,6-hexanediylbis[N'-cyano-: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.
Hazard Classes and CategoriesNot Classified
Safety data
- tsca
- TSCA listed
- Signal word
- Warning
- Symbol(GHS)
- GHS09
- Hazard statements
- H411
- REACH Registrations
- Active
- Precautionary statements
- P211-P232-P233-P235-P260-P281-P301+P312-P301+P330+P331-P302+P352-P304+P340-P305+P351+P338-P309+P311
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationGuanidine, N,N'''-1,6-hexanediylbis[N'-cyano-: ACTIVE
Applications
Uses1,6-Bis(cyano-guanidino)hexane is a compound useful in organic synthesis used in the synthesis and characterization of polybiguanides containing hexamethylene groups.
Upstream & downstream products
Upstream raw materials
Suppliers100 total
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]
艾吉析科技（上海）有限公司17717235263 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
湖北科麦迪化工有限公司18372743325 · [email protected]
湖北成丰化工有限公司13125175253 · [email protected]
武汉欣扬瑞和化学科技有限公司13720274133 · [email protected]
山东海舟生物工程有限公司130-0567-0367 13006570367 · [email protected]
杭州品高化工有限公司0571-87658025 · [email protected]
陕西帕尼尔生物科技有限公司029-84385017-8003 13259417953 · [email protected]
湖北金梭生物科技有限公司00123456789 · [email protected]
INTATRADE GmbH+49 3493/605464 · [email protected]
河北创海生物科技有限公司+86-86-13131129325 · [email protected]
陕西缔都化学有限公司029-029-81123119 17391733320 · [email protected]
Hebei Yanxi Chemical Co., Ltd.+86-17531190177 · [email protected]
武汉绿景丰华生物科技有限公司19972070065 · [email protected]
衢州明锋化工有限公司0570-3062502 13819002126;13819008176 · [email protected]
辽宁佳合晟世医药科技股份有限公司13464671885 13032431717 · [email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
武汉易泰科技有限公司上海分公司18930552037 · [email protected]
武汉市聚舜化工有限公司027-02783261126 18971318572 · [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]
湖北兴琰新材料科技有限公司13129948835 · [email protected]
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广东方信生物科技有限公司0751-2838688 13376594225 · [email protected]
西安康诺化工有限公司029-86107037-8014 18292830413 · [email protected]
湖北健楚生物医药有限公司027-65528353 13554206703 · [email protected]
武汉贝乐叶生物医药科技有限公司18086118076; 18086118070 · [email protected]
Hebei Qige Biological Technology Co. Ltd+86 +8618733132031
深圳菲斯生物科技有限公司0755-83725681-603
武汉卡诺斯科技有限公司153-37111468 15337111468 · [email protected]
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湖北隆信化工实业有限公司15271551270 · [email protected]
北京奥秘佳得医药科技有限公司+86-13522808617 · [email protected]
上海石洋化工有限公司021-56795766 · [email protected]
凯试（上海）科技有限公司021-50135380 · [email protected]
池州凯隆进出口贸易有限公司[email protected]
西安方昊化工有限公司029-88665278 13379235092;15091323866 · [email protected]
Alfa Chemistry1-516-6625404 · [email protected]
Henan Alfa Chemical Co., Ltd+8618339805032 · [email protected]
湖北军瑞生物科技有限公司13971166412 · [email protected]
武汉峰耀同辉化学制品有限公司027-87466205 15377579727 · [email protected]
厦门志信化学有限公司+86-5922680277 +86-13806087780 · [email protected]
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广东翁江化学试剂有限公司0751-2886766 13927870850 · [email protected]
Alfa Chemistry+1-5166625404 · [email protected]
泰安市江舟生物科技有限公司1385-13854830383 13854830383 · [email protected]
Related reactions
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Compound notes
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