3-METHYL-5-OXO-5-PHENYLVALERICACID
-
3-METHYL-5-OXO-5-PHENYLVALERICACID
structure -
-
CAS No:
2840-61-1
-
Formula:
C12H14O3
-
Chemical Name:
3-METHYL-5-OXO-5-PHENYLVALERICACID
-
Synonyms:
4-Benzoyl-3-methylbutyricacid;3-METHYL-5-OXO-5-PHENYLVALERICACID;3-Methy-5-oxo-5-phenylpentanoicacid;3-Methyl-5-oxo-5-phenylpentanoicacid;3-Methy-5-oxo-5-phenylpentanoicacid98%;beta-Methyl-delta-oxobenzenepentanoicacid
-
CAS No:
Characteristics
54.37000
1.84
1.1±0.1 g/cm3
78.5-79.5℃
382.7±25.0 °C at 760 mmHg
199.4±19.7 °C
1.531
1.54E-06mmHg at 25°C
Safety Information
|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Computed Properties
Molecular Weight:206.24
XLogP3:1.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:5
Exact Mass:206.094294304
Monoisotopic Mass:206.094294304
Topological Polar Surface Area:54.4
Heavy Atom Count:15
Complexity:229
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
3-METHYL-5-OXO-5-PHENYLVALERICACID
SDSRequest for Quotation