Basic information
- CAS
19623-16-6- Standard SMILES
Cl.NC1=NCC(OC(=O)c2ccccc2)CN1- InChIKey
ZUZJSWCFJNUVDF-UHFFFAOYSA-N- Molecular formula
- C11H14ClN3O2
- Average molar mass
- 255.7 g/mol
- Monoisotopic mass
- 255.0774544
Overview
structure
Names & identifiers
- Preferred name
- HM 197
- IUPAC
- (2-amino-1,4,5,6-tetrahydropyrimidin-5-yl) benzoate;hydrochloride
- English name
- HM-197
- Molecular formula
- C11H14ClN3O2
- Molecular weight
- 255.70076
Names & synonyms
5-Benzoyl-2-iminohexahydropyrimidine19623-16-6HM 197DTXSID80173302HM-197RefChem:146610DTXCID1095793(2-amino-1,4,5,6-tetrahydropyrimidin-5-yl) benzoate;hydrochloride2-Iminohexahydropyrimidin-5-yl benzoate hydrochloride5-Benzoyloxy-2-iminohexahydropyrimidine hydrochlorideHexahydro-2-imino-5-pyrimidinol benzoate (ester) hydrochloride5-Pyrimidinol, 2-amino-1,4,5,6-tetrahydro-, benzoate (ester), monohydrochloride
Show more names
HM-197 HCl5-Pyrimidinol, hexahydro-2-imino-, benzoate (ester), monohydrochloride1,2,3,4,5,6-HEXAHYDRO-2-IMINO-5-PYRIMIDINYL BENZOATE HYDROCHLORIDEAKOS0243381092-Amino-1,4,5,6-tetrahydropyrimidin-5-yl benzoate--hydrogen chloride (1/1)
Database identifiers
- CAS
19623-16-6- PubChem CID
- 197983
- DTXSID
DTXSID80173302- EC Number
- 667-839-8
Properties
Computed structural properties
- Topological polar surface area
- 76.7 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 285
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 319 · H319-H335-H315
- Precautionary statements
- 264 · P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362
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
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 38 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H319-H335-H315
- Precautionary statements
- P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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