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2,2-Dimethyl-5-[(phenylamino)methylene]-1,3-dioxane-4,6-dione

2,2-Dimethyl-5-[(phenylamino)methylene]-1,3-dioxane-4,6-dione structure

CAS No:
15568-92-0
Formula:
C13H13NO4
Chemical Name:
2,2-Dimethyl-5-[(phenylamino)methylene]-1,3-dioxane-4,6-dione
Synonyms:
1,3-Dioxane-4,6-dione,2,2-dimethyl-5-[(phenylamino)methylene]-;Malonic acid,(anilinomethylene)-,cyclic isopropylidene ester;2,2-Propanediol,cyclic (anilinomethylene)malonate;2,2-Dimethyl-5-[(phenylamino)methylene]-1,3-dioxane-4,6-dione

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2,2-Dimethyl-5-[(phenylamino)methylene]-1,3-dioxane-4,6-dione Basic Attributes

Molecular Weight：

247.25 g/mol

Exact Mass：

247.25

DSSTox ID：

DTXSID00341844

Characteristics

PSA：

64.6 Å²

Melting Point：

156-157 °C

Safety Information

GHS Classification：

|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 38 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:247.25
XLogP3:2.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:2
Exact Mass:247.08445790
Monoisotopic Mass:247.08445790
Topological Polar Surface Area:64.6
Heavy Atom Count:18
Complexity:359
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2,2-Dimethyl-5-[(phenylamino)methylene]-1,3-dioxane-4,6-dione

Basic Attributes
Characteristics
Safety Information
Computed Properties

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