Basic information
- CAS
25070-79-5- Standard SMILES
C=CCOC(=O)Nc1cccc(Cl)c1- InChIKey
AKUHKJFFZQUCEH-UHFFFAOYSA-N- Molecular formula
- C10H10ClNO2
- Average molar mass
- 211.64 g/mol
- Monoisotopic mass
- 211.0400063
Names & identifiers
- Preferred name
- Carbanilic acid, m-chloro-, allyl ester
- IUPAC
- prop-2-enyl N-(3-chlorophenyl)carbamate
- English name
- 3-Chlorophenylcarbamic acid allyl ester
- Molecular formula
- C10H10ClNO2
- Molecular weight
- 211.64
Names & synonyms
25070-79-5m-Chlorophenylcarbamic acid allyl esterNYF9ZD4NKWCARBANILIC ACID, m-CHLORO-, ALLYL ESTERNSC 29689BRN 3267809Carbamic acid, m-chlorophenyl-, allyl esterNSC-29689DTXSID401797642-PROPEN-1-YL N-(3-CHLOROPHENYL)CARBAMATECARBAMIC ACID, N-(3-CHLOROPHENYL)-, 2-PROPEN-1-YL ESTERRefChem:574148
Show more names
ALLYL 3'-CHLOROCARBANILATEALLYL 3'-CHLOROCARBANILATE3-Chlorophenylcarbamic acid allyl esterN-(3-Chlorophenyl)carbamic acid allyl ester
DTXCID00102255Allyl (3-chlorophenyl)carbamateUNII-NYF9ZD4NKWWLN: GR CMVO2UU1allyl 3-chlorophenylcarbamateSCHEMBL7011472Carbamic acid,N-(3-chlorophenyl)-, 2-propen-1-yl esterAKUHKJFFZQUCEH-UHFFFAOYSA-N
Database identifiers
- CAS
25070-79-5- PubChem CID
- 32780
- DTXSID
DTXSID40179764- UNII
- NYF9ZD4NKW
- EC Number
- 667-080-2
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 38.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 208
Physicochemical properties
- FDA UNII
- 9 ZD4NKW · NYF9ZD4NKW
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302
- Precautionary statements
- 264 · P264-P270-P301+P312-P330-P501
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]
P264, P270, P301+P317, P330, 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.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302
- Precautionary statements
- P264-P270-P301+P312-P330-P501
Chemistry & industry
Suppliers2 total
陕西缔都医药化工有限公司+86-29-87569262 +86-15003564040 · [email protected]
淄博航宇生物科技发展有限公司+86-0533-2185556 +86-15965530500 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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