Basic information
- CAS
27931-45-9- Standard SMILES
CCCCN=C(N(C)C)N(C)C- InChIKey
ABQPZGFRMFRBBC-UHFFFAOYSA-N- Molecular formula
- C9H21N3
- Average molar mass
- 171.28 g/mol
- Monoisotopic mass
- 171.17354768
Names & identifiers
- Preferred name
- N''-Butyl-N,N,N',N'-tetramethyl-guanidine
- IUPAC
- 2-butyl-1,1,3,3-tetramethylguanidine
- English name
- 2-butyl-1,1,3,3-tetramethylguanidine
- Molecular formula
- C9H21N3
- Molecular weight
- 171.28
Names & synonyms
27931-45-9DTXSID30335458N''-Butyl-N,N,N',N'-tetramethyl-guanidineRefChem:357993DTXCID802865472-butyl-1,1,3,3-tetramethylguanidineN''-Butyl-N,N,N',N'-tetramethyl -guanidineGuanidine, N''-butyl-N,N,N',N'-tetramethyl-N''-BUTYL-N,N,N',N'-TETRAMETHYLGUANIDINESCHEMBL251998MFCD28362533DB-251412
Show more names
N"-butyl-N,N,N',N'-tetramethyl guanidineN,N,N',N'-tetramethyl-N''-butylguanidineH61445
Database identifiers
- CAS
27931-45-9- PubChem CID
- 525255
- DTXSID
DTXSID30335458- Nikkaji
- J2.479.892E
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 18.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 5
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 129
Experimental & physicochemical properties
Kovats Retention Index1160
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302
- Precautionary statements
- 280 · P280-P305+P351+P338
Safety & regulation
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Suppliers3 total
北京禾兴源科技有限公司18511709189 · [email protected]
HANGZHOU CLAP TECHNOLOGY CO.,LTD86-571-88216897,88216896 13588875226 · [email protected]
Hefei TNJ Chemical Industry Co.,Ltd.+86-0551-65418671 +86-189 4982 3763 · [email protected]
Related reactions
5 records
Compound notes
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