Basic information
- CAS
1394668-81-5- Standard SMILES
CC(C)C(=O)Nc1ccc(OCC(=N)N)cc1.Cl- InChIKey
YRVMEWOLIOZBFV-UHFFFAOYSA-N- Molecular formula
- C12H18ClN3O2
- Average molar mass
- 271.74 g/mol
- Monoisotopic mass
- 271.1087545
Names & identifiers
- Preferred name
- N-[4-(carbamimidoylmethoxy)phenyl]-2-methylpropanamide hydrochloride
- IUPAC
- N-[4-(2-amino-2-iminoethoxy)phenyl]-2-methylpropanamide;hydrochloride
- English name
- N-[4-(carbamimidoylmethoxy)phenyl]-2-methylpropanamide hydrochloride
- Molecular formula
- C12H18ClN3O2
- Molecular weight
- 271.75
Names & synonyms
N-[4-(carbamimidoylmethoxy)phenyl]-2-methylpropanamide hydrochloride1394668-81-5N-(4-(carbamimidoylmethoxy)phenyl)-2-methylpropanamide hydrochlorideRefChem:827020980-638-2N-[4-(2-amino-2-iminoethoxy)phenyl]-2-methylpropanamide;hydrochlorideUFC66881AKOS016972453CS-0222635EN300-112041Z1438483162N-[4-(carbamimidoylmethoxy)phenyl]-2-methylpropanamidehydrochloride
Show more names
N-[4-(2-amino-2-imino-ethoxy)phenyl]-2-methyl-propanamide;hydrochloride
Database identifiers
- CAS
1394668-81-5- PubChem CID
- 71756567
- EC Number
- 980-638-2
Properties
Computed structural properties
- Topological polar surface area
- 88.2 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 271
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
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
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Suppliers2 total
A2B Chem LLC[email protected]
宝欧信特生物科技（苏州）有限公司51288865780 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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