Product Name: p-tert-Butylphenol sodium salt (CAS NO.5787-50-8)
Molecular Formula: C10H13NaO
Molecular Weight: 172.19939g/mol
Mol File: 5787-50-8.mol
Einecs: 227-318-4
Boiling point: 233.7 °C at 760 mmHg
Flash Point: 110.9 °C
Enthalpy of Vaporization: 48.95 kJ/mol
Vapour Pressure: 0.0361 mmHg at 25°C
H-Bond Donor: 0
H-Bond Acceptor: 1
Structure Descriptors of p-tert-Butylphenol sodium salt (CAS NO.5787-50-8):
IUPAC Name: sodium 4-tert-butylphenolate
Canonical SMILES: CC(C)(C)C1=CC=C(C=C1)[O-].[Na+]
InChI: InChI=1S/C10H14O.Na/c1-10(2,3)8-4-6-9(11)7-5-8;/h4-7,11H,1-3H3;/q;+1/p-1
InChIKey: QDJPHAPWEUQBKS-UHFFFAOYSA-M
Reported in EPA TSCA Inventory. EPA FIFRA 1988 pesticide subject to registration or re-registration.
A pesticide with unreported toxicity. When heated to decomposition it emits acrid smoke and irritating vapors.
p-tert-Butylphenol sodium salt ,its CAS NO. is 5787-50-8,the synonyms is 4-(1,1-Dimethylethyl)phenol sodium salt ; Caswell No. 130G ; EINECS 227-318-4 ; EPA Pesticide Chemical Code 064115 ; Phenol, 4-(1,1-dimethylethyl)-, sodium salt ; Sodium p-tert-butylphenolate .
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