1-(3-Chlorophenyl)cyclobutanecarboxylic acid
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Basic information
- CAS
151157-55-0- Standard SMILES
O=C(O)C1(c2cccc(Cl)c2)CCC1- InChIKey
RCVMSQRTMODMHH-UHFFFAOYSA-N- Molecular formula
- C11H11ClO2
- Average molar mass
- 210.65 g/mol
- Monoisotopic mass
- 210.0447573
Names & identifiers
- Preferred name
- 1-(3-Chlorophenyl)cyclobutanecarboxylic acid
- IUPAC
- 1-(3-chlorophenyl)cyclobutane-1-carboxylic acid
- English name
- 1-(3-CHLOROPHENYL)CYCLOBUTANECARBOXYLIC ACID
- Molecular formula
- C11H11ClO2
- Molecular weight
- 210.66
Names & synonyms
1-(3-chlorophenyl)cyclobutanecarboxylic acid151157-55-01-(3-chlorophenyl)cyclobutane-1-carboxylic acidDTXSID20349387RefChem:423692DTXCID20300458668-309-9MFCD03408895MLS000032593ChemDiv2_0024081-(3-Chloro-phenyl)-cyclobutanecarboxylic acidOprea1_249147
Show more names
1-(3-chlorophenyl)cyclobutylmacetic acid1-(3-chlorophenyl) cyclobutyl formic acidCyclobutanecarboxylic acid, 1-(3-chlorophenyl)-1-Carboxy-1-(3-chlorophenyl)cyclobutane, 1-(1-Carboxycyclobut-1-yl)-3-chlorobenzene
SCHEMBL9466663CHEMBL1306226RCVMSQRTMODMHH-UHFFFAOYSA-NHMS1375N10HMS2322P12BGA15755SBB007419STK679237
Database identifiers
- CAS
151157-55-0- PubChem CID
- 644449
- DTXSID
DTXSID20349387- ChEMBL
CHEMBL1306226- EC Number
- 668-309-9
Properties
Computed structural propertiesFilling in
- XLogP
- 2.9
- Topological polar surface area
- 37.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 235
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07,GHS05
- Signal word
- Danger
- Hazard statements
- 335 · H335-H315-H318
- Precautionary statements
- 280 · P280-P305+P351+P338-P310-P264-P280-P302+P352-P321-P332+P313-P362
- HS Code
- 2916200090 · 2916200090
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
Danger
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P332+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 2 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
- hs_code
- 2916200090
- Signal word
- Danger
- Symbol(GHS)
- GHS07,GHS05
- Hazard statements
- H335-H315-H318
- Precautionary statements
- P280-P305+P351+P338-P310-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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