Benzocyclobutyl-1-carboxylic acid
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Benzocyclobutyl-1-carboxylic acid
structure -
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CAS No:
14381-41-0
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Formula:
C9H8O2
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Chemical Name:
Benzocyclobutyl-1-carboxylic acid
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Synonyms:
RARECHEM AL BO 1235;1-BENZOCYCLOBUTENECARBOXYLIC ACID;BENZOCYCLOBUTYL-1-CARBOXYLIC ACID;1-carboxyl benzocyclobutene;Bicyclo[4.2.0]octa-1,3,5-triene-7-carboxylic acid (6CI,7CI,8CI,9CI);Bicyclo[4.2.0]octa-1,3,5-triene-7-carboxylic acid;1-benzylcyclobutane-1-carboxylic acid;1-Benzocyclobutenecarboxylic acid
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CAS No:
Characteristics
37.3
1.41090
White to pale brown Crystalline Powder or Powder
1.31 g/cm3
75-77 °C(lit.)
318.6ºC at 760 mmHg
142.4ºC
1.624
Safety Information
NONH for all modes of transport
3
36/37/38
26-37/39
Xi
P261-P305 + P351 + P338
H315-H319-H335
|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|Aggregated GHS information provided by 40 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:148.16
XLogP3:1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:148.052429494
Monoisotopic Mass:148.052429494
Topological Polar Surface Area:37.3
Heavy Atom Count:11
Complexity:176
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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Benzocyclobutyl-1-carboxylic acid
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