Benzoic acid, 4-propyl-, 4-cyanophenyl ester
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Benzoic acid, 4-propyl-, 4-cyanophenyl ester
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CAS No:
56131-49-8
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Formula:
C17H15NO2
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Chemical Name:
Benzoic acid, 4-propyl-, 4-cyanophenyl ester
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Synonyms:
Benzoic acid,4-propyl-,4-cyanophenyl ester;4-Cyanophenyl 4-propylbenzoate;p-Cyanophenyl p-n-propylbenzoate;3-BEB-C
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CAS No:
Benzoic acid, 4-propyl-, 4-cyanophenyl ester Basic Attributes
350.86500
265.31
417-330-1
DTXSID10343495
2926909090
Safety Information
III
6.1
UN3439
H413 (100%): May cause long lasting harmful effects to aquatic life [Hazardous to the aquatic environment, long-term hazard]|P273, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Computed Properties
Molecular Weight:265.31
XLogP3:4.4
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:5
Exact Mass:265.110278721
Monoisotopic Mass:265.110278721
Topological Polar Surface Area:50.1
Heavy Atom Count:20
Complexity:354
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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