2,2-Dimethylglutaric acid
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2,2-Dimethylglutaric acid
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CAS No:
681-57-2
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Formula:
C7H12O4
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Chemical Name:
2,2-Dimethylglutaric acid
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Synonyms:
Pentanedioic acid,2,2-dimethyl-;Glutaric acid,2,2-dimethyl-;2,2-Dimethylpentanedioic acid;2,2-Dimethylglutaric acid;2,2-dimethylpentanedioic acid;NSC 61979;1,1-Dimethyl-1,3-propanedicarboxylic acid
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CAS No:
Description
white granular powder
2,2-dimethylglutaric acid is an alpha,omega-dicarboxylic acid that is pentanedioic acid with two methyl groups substituted at position C-2. It has a role as a metabolite.
2,2-Dimethylglutaric acid Basic Attributes
160.168
160.17
211-655-9
S46AMQ2G6C
61979
DTXSID6021585
2917190090
Characteristics
74.60000
-0.34
White to pale yellow powder
1.2±0.1 g/cm3
83-85 °C
180-200 °C @ Press: 2 Torr
149.7±16.9 °C
1.475
It hydrolyzes with water.
Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances.
Safety Information
NONH for all modes of transport
3
R36/37/38
S22-S24/25
Xi
Stable under normal temperatures and pressures.
P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, P501
H315
|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 16 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:160.17
XLogP3:0.7
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:160.07355886
Monoisotopic Mass:160.07355886
Topological Polar Surface Area:74.6
Heavy Atom Count:11
Complexity:171
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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