4-Chlorobutanoic acid
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4-Chlorobutanoic acid
structure -
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CAS No:
627-00-9
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Formula:
C4H7ClO2
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Chemical Name:
4-Chlorobutanoic acid
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Synonyms:
Butanoic acid,4-chloro-;Butyric acid,4-chloro-;4-Chlorobutanoic acid;4-Chlorobutyric acid;γ-Chlorobutyric acid;NSC 6391;NSC 76578;4-Chlorobutyrate
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CAS No:
Characteristics
37.3
0.6
1.2373 g/cm3 @ Temp: 20 °C
16 °C
114 °C @ Press: 16 Torr
101.1±22.6 °C
1.449
Safety Information
Ⅱ
8
3265
3
8
S26-S36/37/39-S45
C: Corrosive;
P280-P305 + P351 + P338-P310
H302-H314
UN 3265 8/PG 2
|Danger|H302 (97.56%): Harmful if swallowed [Warning Acute toxicity, oral]|P260, P264, P270, P280, P301+P312, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P330, P363, P405, and P501|Aggregated GHS information provided by 41 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:122.55
XLogP3:0.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:122.0134572
Monoisotopic Mass:122.0134572
Topological Polar Surface Area:37.3
Heavy Atom Count:7
Complexity:62.7
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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