2,4,4-trimethylpentane-2,3-diol
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2,4,4-trimethylpentane-2,3-diol
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CAS No:
64512-96-5
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Formula:
C8H18O2
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Chemical Name:
2,4,4-trimethylpentane-2,3-diol
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Synonyms:
2,4,4-Trimethyl-2,3-pentanediol;2,4,4-trimethylpentane-2,3-diol;64512-96-5;NSC51955;SCHEMBL4436411;DTXSID40287651;DTXSID40993902;NSC-51955;AKOS024332502;MCULE-4003683445;73174-88-6
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CAS No:
2,4,4-trimethylpentane-2,3-diol Basic Attributes
146.23 g/mol
146.130679813 g/mol
51955
DTXSID40287651
Safety Information
|Warning|H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]|P264, P280, P305+P351+P338, and P337+P313|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory.
Computed Properties
Molecular Weight:146.23
XLogP3:1.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:146.130679813
Monoisotopic Mass:146.130679813
Topological Polar Surface Area:40.5
Heavy Atom Count:10
Complexity:111
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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