CAS
93805-83-5 Purity
96%
93805-83-5 Purity
96%
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Calcium N-(3-carboxylato-1-oxopropyl)-DL-methionate
CAS
93805-87-9
Catalog Number
ACM93805879
Category
Other Products
Molecular Weight
287.3462
Molecular Formula
C9H15 N O5 S . Ca
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Specification
Synonyms
EINECS 298-572-1, Calcium N-(3-carboxylato-1-oxopropyl)-DL-methionate, 93805-87-9
IUPAC Name
calcium;2-(3-carboxylatopropanoylamino)-4-methylsulfanylbutanoate
Canonical SMILES
CSCCC(C(=O)[O-])NC(=O)CCC(=O)[O-].[Ca+2]
InChI Key
PTINZVAKLQSFJY-UHFFFAOYSA-L
Density
g/cm³
EC Number
298-572-1
Exact Mass
287.01400
H-Bond Acceptor
6
H-Bond Donor
1
What is the molecular formula of Calcium N-(3-carboxylato-1-oxopropyl)-DL-methionate?
The molecular formula is C9H13CaNO5S.
What are the synonyms of Calcium N-(3-carboxylato-1-oxopropyl)-DL-methionate?
The synonyms are EINECS 298-572-1 and 93805-87-9.
What is the molecular weight of Calcium N-(3-carboxylato-1-oxopropyl)-DL-methionate?
The molecular weight is 287.35 g/mol.
What is the IUPAC name of Calcium N-(3-carboxylato-1-oxopropyl)-DL-methionate?
The IUPAC name is calcium;2-(3-carboxylatopropanoylamino)-4-methylsulfanylbutanoate.
What is the InChI of Calcium N-(3-carboxylato-1-oxopropyl)-DL-methionate?
The InChI is InChI=1S/C9H15NO5S.Ca/c1-16-5-4-6(9(14)15)10-7(11)2-3-8(12)13;/h6H,2-5H2,1H3,(H,10,11)(H,12,13)(H,14,15);/q;+2/p-2.
What is the InChIKey of Calcium N-(3-carboxylato-1-oxopropyl)-DL-methionate?
The InChIKey is PTINZVAKLQSFJY-UHFFFAOYSA-L.
What is the canonical SMILES of Calcium N-(3-carboxylato-1-oxopropyl)-DL-methionate?
The canonical SMILES is CSCCC(C(=O)[O-])NC(=O)CCC(=O)[O-].[Ca+2].
What is the CAS number of Calcium N-(3-carboxylato-1-oxopropyl)-DL-methionate?
The CAS number is 93805-87-9.
What is the European Community (EC) Number of Calcium N-(3-carboxylato-1-oxopropyl)-DL-methionate?
The EC Number is 298-572-1.
What is the formal charge of Calcium N-(3-carboxylato-1-oxopropyl)-DL-methionate?
The formal charge is 0.
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