CAS
93965-14-1 Purity
96%
93965-14-1 Purity
96%
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(2-Mercaptoethyl)ammonium hydrogen maleate
CAS
93965-19-6
Catalog Number
ACM93965196
Category
Other Products
Molecular Weight
193.220840 [g/mol]
Molecular Formula
C4H4O4.C2H7NS
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Specification
Synonyms
60-23-1 (Parent), EINECS 300-968-7, (2-Mercaptoethyl)ammonium hydrogen maleate, 93965-19-6
IUPAC Name
(Z)-4-hydroxy-4-oxobut-2-enoate; 2-sulfanylethylazanium
Canonical SMILES
C(CS)[NH₃+].C(=CC(=O)[O-])C(=O)O
InChI Key
CFKWMOSBWWKRJM-ODZAUARKSA-N
EC Number
300-968-7
H-Bond Acceptor
4
H-Bond Donor
2
What is the molecular formula of (2-Mercaptoethyl)ammonium hydrogen maleate?
The molecular formula is C6H11NO4S.
When was (2-Mercaptoethyl)ammonium hydrogen maleate created and modified?
It was created on August 20, 2009, and modified on December 30, 2023.
What is the IUPAC name of (2-Mercaptoethyl)ammonium hydrogen maleate?
The IUPAC name is (Z)-4-hydroxy-4-oxobut-2-enoate;2-sulfanylethylazanium.
What is the InChIKey of (2-Mercaptoethyl)ammonium hydrogen maleate?
The InChIKey is CFKWMOSBWWKRJM-ODZAUARKSA-N.
How many hydrogen bond donor counts does (2-Mercaptoethyl)ammonium hydrogen maleate have?
It has 3 hydrogen bond donor counts.
What is the exact mass of (2-Mercaptoethyl)ammonium hydrogen maleate?
The exact mass is 193.04087901 g/mol.
How many hydrogen bond acceptor counts does (2-Mercaptoethyl)ammonium hydrogen maleate have?
It has 5 hydrogen bond acceptor counts.
What is the topological polar surface area of (2-Mercaptoethyl)ammonium hydrogen maleate?
The topological polar surface area is 106 Ų.
How many rotatable bond counts does (2-Mercaptoethyl)ammonium hydrogen maleate have?
It has 2 rotatable bond counts.
Is the compound canonicalized?
Yes, the compound is canonicalized.
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