4-Chlorobutyrophenone
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4-Chlorobutyrophenone
structure -
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CAS No:
939-52-6
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Formula:
C10H11ClO
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Chemical Name:
4-Chlorobutyrophenone
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Synonyms:
1-Butanone,4-chloro-1-phenyl-;Butyrophenone,4-chloro-;4-Chloro-1-phenyl-1-butanone;γ-Chlorobutyrophenone;4-Chlorobutyrophenone;3-Benzoylpropyl chloride;3-Chloropropyl phenyl ketone;1-Benzoyl-3-chloropropane;NSC 76579
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CAS No:
Characteristics
17.07000
2.88830
1.149 g/cm3 @ Temp: 20 °C
19.5 °C
133.5-135 °C @ Press: 11 Torr
>230 °F
n20/D 1.544(lit.)
Safety Information
UN 2927 6.1/PG 1
3
S23-S24/25
Xi: Irritant;
P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, P501
H315
|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:182.64
XLogP3:2.5
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:4
Exact Mass:182.0498427
Monoisotopic Mass:182.0498427
Topological Polar Surface Area:17.1
Heavy Atom Count:12
Complexity:139
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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