4'-Iodosuccinanilic acid
Basic information
- CAS
62134-54-7- Standard SMILES
O=C(O)CCC(=O)Nc1ccc(I)cc1- InChIKey
UEWAGINHLGZFAM-UHFFFAOYSA-N- Molecular formula
- C10H10INO3
- Average molar mass
- 319.1 g/mol
- Monoisotopic mass
- 318.97054
Names & identifiers
- Preferred name
- 4'-Iodosuccinanilic acid
- IUPAC
- 4-(4-iodoanilino)-4-oxobutanoic acid
- English name
- ASISCHEM D13218
- Molecular formula
- C10H10INO3
- Molecular weight
- 319.1
Names & synonyms
4'-iodosuccinanilic acidRefChem:506155666-373-262134-54-74-((4-Iodophenyl)amino)-4-oxobutanoic acid3-[(4-iodophenyl)carbamoyl]propanoic acid4-(4-iodoanilino)-4-oxobutanoic acidSBB0155463-[N-(4-iodophenyl)carbamoyl]propanoic acidCBDivE_008459MFCD00029844Cambridge id 5133961
Show more names
AURORA 3093ASISCHEM D13218OTAVA-BB BB7110950150Butanoic acid, 4-[(4-iodophenyl)amino]-4-oxo-
Oprea1_242268Oprea1_433014SCHEMBL7822000DTXSID30350606AKOS0002731004-(4-iodoanilino)-4-oxo-butanoic acidNS-053484-((4-Iodophenyl)amino)-4-oxobutanoicacid
Database identifiers
- CAS
62134-54-7- PubChem CID
- 684076
- DTXSID
DTXSID30350606- EC Number
- 666-373-2
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 66.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 237
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H312-H332
- Precautionary statements
- 261 · P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P330-P363-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-H312-H332
- Precautionary statements
- P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P330-P363-P501
Suppliers
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Related reactions
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Compound notes
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