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(2,2-Dimethyl-1,3-dioxolan-4-yl)acetic acid

HCID 14141014
NotesReactions
Basic informationNames & identifiersPropertiesSafety & regulationRelated reactionsCompound notes
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Basic information

CAS
210297-55-5
Standard SMILES
CC1(C)OCC(CC(=O)O)O1
InChIKey
OIUZBDNWEHNDHO-UHFFFAOYSA-N
Molecular formula
C7H12O4
Average molar mass
160.17 g/mol
Monoisotopic mass
160.07355886

Names & identifiers

Preferred name
(2,2-Dimethyl-1,3-dioxolan-4-yl)acetic acid
IUPAC
2-(2,2-dimethyl-1,3-dioxolan-4-yl)acetic acid

Names & synonyms

210297-55-52-(2,2-dimethyl-1,3-dioxolan-4-yl)acetic acid(2,2-Dimethyl-1,3-dioxolan-4-yl)acetic acidSCHEMBL2066108DTXSID70556443AKOS006315677EN300-1428644

Database identifiers

CAS
210297-55-5
PubChem CID
14141014
DTXSID
DTXSID70556443
EC Number
129-983-5

Properties

Computed structural properties

XLogP
0
Topological polar surface area
55.8 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
2
Heavy atoms
11
Formal charge
0
Complexity
164

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

GHS classification

GHS Classification · 4 items

Danger

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P332+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Hazard information

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

Related reactions

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Compound notes

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