β-Alanine, N-(2,4-dihydroxy-3,3-dimethyl-1-oxobutyl)-, calcium salt (2:1)
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β-Alanine, N-(2,4-dihydroxy-3,3-dimethyl-1-oxobutyl)-, calcium salt (2:1)
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CAS No:
6381-63-1
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Formula:
C9H17NO5.1/2Ca
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Chemical Name:
β-Alanine, N-(2,4-dihydroxy-3,3-dimethyl-1-oxobutyl)-, calcium salt (2:1)
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Synonyms:
β-Alanine,N-(2,4-dihydroxy-3,3-dimethyl-1-oxobutyl)-,calcium salt (2:1);Pantothenic acid,calcium salt (2:1),DL-;β-Alanine,N-(2,4-dihydroxy-3,3-dimethyl-1-oxobutyl)-,calcium salt (2:1),(±)-;Racemic calcium pantothenate;Calcium DL-pantothenate;DL-Calcium pantothenate;Bis[3-[(2,4-dihydroxy-3,3-dimethylbutanoyl)amino]propanoyloxy]calcium;Calcium bis[3-[(2,4-dihydroxy-3,3-dimethylbutanoyl)amino]propanoate];Calcium 3-[(2,4-dihydroxy-3,3-dimethylbutanoyl)amino]propanoate;7693-17-6;131346-21-9;1298118-12-3
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CAS No:
Description
Calcium DL-pantothenate is an organooxygen compound and an organonitrogen compound. It derives from a beta-amino acid.
β-Alanine, N-(2,4-dihydroxy-3,3-dimethyl-1-oxobutyl)-, calcium salt (2:1) Basic Attributes
476.53200
476.16800
613-213-4
2936240000
β-Alanine, N-(2,4-dihydroxy-3,3-dimethyl-1-oxobutyl)-, calcium salt (2:1) Use and Manufacturing
Vitamin (enzyme cofactor).
.beta.-Alanine, N-(2,4-dihydroxy-3,3-dimethyl-1-oxobutyl)-, calcium salt (2:1): INACTIVE
EPA Safer Chemical Functional Use Classes -> Skin Conditioning Agents|Safer Chemical Classes -> Green half-circle - The chemical is expected to be of low concern
Computed Properties
Molecular Weight:476.5
Hydrogen Bond Donor Count:6
Hydrogen Bond Acceptor Count:10
Rotatable Bond Count:10
Exact Mass:476.1682861
Monoisotopic Mass:476.1682861
Topological Polar Surface Area:219
Heavy Atom Count:31
Complexity:233
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:3
Compound Is Canonicalized:Yes
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β-Alanine, N-(2,4-dihydroxy-3,3-dimethyl-1-oxobutyl)-, calcium salt (2:1)
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