CAS 5735-97-7 2-(2-Methyl-1,3-dioxolan-2-yl)acetic acid (HCID 560044)

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Basic information

CAS: 5735-97-7
Standard SMILES: CC1(CC(=O)O)OCCO1
InChIKey: FTKBXLIEUSEMPP-UHFFFAOYSA-N
Molecular formula: C6H10O4
Average molar mass: 146.14 g/mol
Monoisotopic mass: 146.0579088

Names & identifiers

Preferred name: 2-(2-Methyl-1,3-dioxolan-2-yl)acetic acid
IUPAC: 2-(2-methyl-1,3-dioxolan-2-yl)acetic acid
English name: 2-(2-Methyl-1.3-dioxolan-2-yl)acetic acid
Molecular formula: C6H10O4
Molecular weight: 146.14

Names & synonyms

2-(2-methyl-1,3-dioxolan-2-yl)acetic acid5735-97-7RefChem:454124871-339-72-(2-METHYL-1.3-DIOXOLAN-2-YL)ACETIC ACIDMFCD056258171,3-Dioxolane-2-acetic acid, 2-methyl-(2-methyl-[1,3]dioxolan-2-yl)-acetic acid(2-Methyl-1,3-dioxolan-2-yl)acetic acidSCHEMBL40974953,3-ethylenedioxy-butanoic acid2-methyldioxolan-2-ylacetic acid

Show more names

2-methyldioxolane-2-ylacetic acidFAA73597AKOS000291349AS-65110SY4212892-(2-methyl-1,3-dioxolan-2-yl)aceticacidCS-0060072(2-Methyl-1,3-dioxolan-2-yl)acetic acid #

Database identifiers

CAS: 5735-97-7
PubChem CID: 560044
EC Number: 871-339-7
Nikkaji: J1.416.474J

Properties

Computed structural properties

XLogP: -0.4
Topological polar surface area: 55.8 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 4
Rotatable bonds: 2
Heavy atoms: 10
Formal charge: 0
Complexity: 137

Physicochemical properties

storage temp.: Store at room temperature
Appearance: Colorless to light yellow Liquid
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 335 · H335-H315-H319
Precautionary statements: 264 · P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362

Safety & regulation

GHS classification

GHS Classification · 5 items

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+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%)；Eye Irrit. 2A (100%)；STOT SE 3 (100%)

Safety data

Signal word: Warning
Symbol(GHS): GHS07
Hazard statements: H335-H315-H319
Precautionary statements: P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362