Basic information
- CAS
68227-32-7- Standard SMILES
CC(O)Cn1ccnc1.O=CO- InChIKey
RJKFXAQTFCBIGA-UHFFFAOYSA-N- Molecular formula
- C7H12N2O3
- Average molar mass
- 172.18 g/mol
- Monoisotopic mass
- 172.08479225
Names & identifiers
- Preferred name
- Formic acid, compd. with alpha-methyl-1H-imidazole-1-ethanol (1:1)
- IUPAC
- formic acid;1-imidazol-1-ylpropan-2-ol
Names & synonyms
1-(2-Hydroxypropyl)imidazole formic acid salt68227-32-7DTXSID70887289EINECS 269-347-5RefChem:141234DTXCID101026593SCHEMBL217826NS00090079Formic acid--1-(1H-imidazol-1-yl)propan-2-ol (1/1)Formic acid, compound with alpha-methyl-1H-imidazole-1-ethanol (1:1)
Database identifiers
- CAS
68227-32-7- PubChem CID
- 109232
- DTXSID
DTXSID70887289- EC Number
- 269-347-5
Properties
Computed structural properties
- Topological polar surface area
- 75.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 97.4
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 100% (22 of 22) of all reports.
Not Classified
Aggregated GHS information provided per 22 reports by companies from 1 notifications to the ECHA C&L Inventory.
Hazard information
Regulatory InformationFormic acid, compd. with .alpha.-methyl-1H-imidazole-1-ethanol (1:1): 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
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationFormic acid, compd. with .alpha.-methyl-1H-imidazole-1-ethanol (1:1): ACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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