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isopropoxyaceticacid

isopropoxyaceticacid structure

CAS No:
33445-07-7
Formula:
C5H10O3
Chemical Name:
isopropoxyaceticacid
Synonyms:
isopropoxyacetic acid;UKRORGSYN-BB BBV-083156;acetic acid, (1-methylethoxy)-;isopropoxyacetic acid(SALTDATA: FREE);2-isopropoxyaceticacid;Acetic acid, 2-(1-methylethoxy)-;2-propan-2-yloxyacetic acid;2-propan-2-yloxyethanoic acid
Categories:
Chemical Reagents > Organic Reagents

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isopropoxyaceticacid Basic Attributes

Molecular Weight：

118.13

Exact Mass：

118.062994177 g/mol

DSSTox ID：

DTXSID50333693

Characteristics

PSA：

46.5 Å²

Density：

1.050±0.06 g/cm3

Boiling Point：

113 °C

PKA：

3.49±0.10

Safety Information

Hazard category：

IRRITANT

GHS Classification：

|Danger|H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]|P260, P261, P264, P270, P271, P280, P301+P312, P301+P330+P331, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P310, P312, P321, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501|Aggregated GHS information provided by 2 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:118.13
XLogP3:0.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:118.062994177
Monoisotopic Mass:118.062994177
Topological Polar Surface Area:46.5
Heavy Atom Count:8
Complexity:77.7
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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33445-07-7 2-propan-2-yloxyacetic acid

CAS No.: 33445-07-7

Grade: Industrial Grade

Content: 95%

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