Basic information
- CAS
1113-10-6- Standard SMILES
CCC(C)(C)N=C(N)NC#N- InChIKey
VZVGEDRCVUKSEL-UHFFFAOYSA-N- Molecular formula
- C7H14N4
- Average molar mass
- 154.21 g/mol
- Monoisotopic mass
- 154.12184646
Overview
Guancidine is a member of guanidines.
Names & identifiers
- Preferred name
- N-Cyano-N'-(1,1-dimethylpropyl)guanidine
- IUPAC
- 1-cyano-2-(2-methylbutan-2-yl)guanidine
- English name
- guancidine
- Molecular formula
- C7H14N4
- Molecular weight
- 154.21
Names & synonyms
Guancydine1113-10-6CL 2422CL-242271Y9TQ5U2ZDTXSID0023115N-Cyano-N'-(1,1-dimethylpropyl)guanidineRefChem:927094DTXCID803115214-198-3Guancidine1-cyano-2-(2-methylbutan-2-yl)guanidine
Show more names
2-tert-amyl-1-cyano-guanidine1-Cyano-3-tert-pentylguanidineN''-Cyano-N-(1,1-dimethylpropyl)guanidineGuanidine, N-cyano-N‘-(1,1-dimethylpropyl)-
Guancydine [USAN]GuancidinaN-Cyano-N'-(2-methylbutan-2-yl)guanidine2-Cyano-1-tert-pentylguanidineGuancidine [INN]1-cyano-3-tert-pentylguanidine/Guanidine, N''-cyano-N-(1,1-dimethylpropyl)-Guancydine (USAN)
Database identifiers
- CAS
1113-10-6- PubChem CID
- 14211
- DTXSID
DTXSID0023115- ChEMBL
CHEMBL1697839- ChEBI
CHEBI:134780- UNII
- 71Y9TQ5U2Z
- EC Number
- 214-198-3
Properties
Computed structural properties
- XLogP
- 0.6
- Topological polar surface area
- 74.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 196
Physicochemical properties
- Melting point
- 155.5 · 155.5-157.0 °C
- Boiling point
- 197.3 · 197.3±23.0 °C(Predicted)
- Density
- 1.02 · 1.02±0.1 g/cm3(Predicted)
- storage temp.
- -20 °C · Store at -20°C
- solubility
- 125 · DMSO:125.0(Max Conc. mg/mL);810.55(Max Conc. mM)
- pka
- 3 · 3.00±0.70(Predicted)
- form
- Solid
- color
- White to off-white
- FDA UNII
- 71 Y9TQ5U2Z · 71Y9TQ5U2Z
Chemistry & industry
Applications
UsesAntihypertensive.
Suppliers13 total
河南伊诺凯新材料有限公司15670530983 · [email protected]
天津普西唐生物医药科技有限公司010-60605840 · [email protected]
陕西缔都医药化工有限公司029-81024372 17792795018 · [email protected]
上海陶术生物科技股份有限公司+1-781-999-5354; +1-00000000000 · [email protected]
开封明仁药业有限公司0371-65741762 · [email protected]
上海指月生物科技有限公司13918644899 · [email protected]
东阳市求索医药科技有限公司17502510579 · [email protected]
成都同创源医药科技有限公司028-83379370 13880556291 · [email protected]
上海万千化工有限公司18796480002 18796480002 · [email protected]
上海索本生物科技有限公司13023173052 · [email protected]
TargetMol中国（陶术生物）4008200310 15002144251 · [email protected]
ChemeGen 中国18818260767 · [email protected]
北京索莱宝科技有限公司17801761073 18101056239 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…