CAS
92952-84-6 Purity
96%
92952-84-6 Purity
96%
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3-Aminopropyl methanethiosulfonate,hydrobromide
CAS
92953-13-4
Catalog Number
ACM92953134
Category
Other Products
Molecular Weight
250.18
Molecular Formula
C4H12BrNO2S2
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Specification
Synonyms
MTSPA;3-AMINOPROPYL METHANETHIOSULFONATE, HYDROBROMIDE;3-AMINOPROPYL METHANETHIOSULPHONATE HYDROBROMIDE
IUPAC Name
3-methylsulfonylsulfanylpropan-1-amine;hydrobromide
SMILES
CS(=O)(=O)SCCCN.Br
InChI Key
SKVCHEKULNWKHX-UHFFFAOYSA-N
Boiling Point
339.6ºC at 760 mmHg
Flash Point
159.2ºC
Density
1.27g/cm³
Appearance
White Solid
Exact Mass
248.94900
H-Bond Acceptor
4
H-Bond Donor
1
What is the molecular weight of 3-Aminopropyl methanethiosulfonate, hydrobromide?
The molecular weight of 3-Aminopropyl methanethiosulfonate, hydrobromide is 250.2 g/mol.
What is the IUPAC name of 3-Aminopropyl methanethiosulfonate, hydrobromide?
The IUPAC name of 3-Aminopropyl methanethiosulfonate, hydrobromide is 3-methylsulfonothioyloxypropan-1-amine; hydrobromide.
What is the InChI of 3-Aminopropyl methanethiosulfonate, hydrobromide?
The InChI of 3-Aminopropyl methanethiosulfonate, hydrobromide is InChI=1S/C4H11NO2S2.BrH/c1-9(6,8)7-4-2-3-5;/h2-5H2,1H3;1H.
What is the InChIKey of 3-Aminopropyl methanethiosulfonate, hydrobromide?
The InChIKey of 3-Aminopropyl methanethiosulfonate, hydrobromide is WRAGHSOSSPSMJR-UHFFFAOYSA-N.
What is the canonical SMILES of 3-Aminopropyl methanethiosulfonate, hydrobromide?
The canonical SMILES of 3-Aminopropyl methanethiosulfonate, hydrobromide is CS(=O)(=S)OCCCN.Br.
What is the molecular formula of 3-Aminopropyl methanethiosulfonate, hydrobromide?
The molecular formula of 3-Aminopropyl methanethiosulfonate, hydrobromide is C4H12BrNO2S2.
How many hydrogen bond donor counts are there in 3-Aminopropyl methanethiosulfonate, hydrobromide?
There are 2 hydrogen bond donor counts in 3-Aminopropyl methanethiosulfonate, hydrobromide.
How many hydrogen bond acceptor counts are there in 3-Aminopropyl methanethiosulfonate, hydrobromide?
There are 4 hydrogen bond acceptor counts in 3-Aminopropyl methanethiosulfonate, hydrobromide.
How many rotatable bond counts are there in 3-Aminopropyl methanethiosulfonate, hydrobromide?
There are 4 rotatable bond counts in 3-Aminopropyl methanethiosulfonate, hydrobromide.
Is 3-Aminopropyl methanethiosulfonate, hydrobromide considered canonicalized?
Yes, 3-Aminopropyl methanethiosulfonate, hydrobromide is considered canonicalized.
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