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Structure

trans-4-Cyclopentylamino-1,1-dioxo-tetrahydrothiophen-3-ol hydrochloride

CAS
916901-11-6
Catalog Number
ACM916901116
Category
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What is the molecular formula of trans-4-Cyclopentylamino-1,1-dioxo-tetrahydrothiophen-3-ol hydrochloride?

The molecular formula is C9H18ClNO3S.

What is the molecular weight of trans-4-Cyclopentylamino-1,1-dioxo-tetrahydrothiophen-3-ol hydrochloride?

The molecular weight is 255.76 g/mol.

What is the PubChem CID of the parent compound of trans-4-Cyclopentylamino-1,1-dioxo-tetrahydrothiophen-3-ol hydrochloride?

The PubChem CID of the parent compound is 22692490.

What is the IUPAC name of trans-4-Cyclopentylamino-1,1-dioxo-tetrahydrothiophen-3-ol hydrochloride?

The IUPAC name is (3R,4R)-4-(cyclopentylamino)-1,1-dioxothiolan-3-ol;hydrochloride.

What is the InChI of trans-4-Cyclopentylamino-1,1-dioxo-tetrahydrothiophen-3-ol hydrochloride?

The InChI is InChI=1S/C9H17NO3S.ClH/c11-9-6-14(12,13)5-8(9)10-7-3-1-2-4-7;/h7-11H,1-6H2;1H/t8-,9-;/m0./s1.

What is the InChIKey of trans-4-Cyclopentylamino-1,1-dioxo-tetrahydrothiophen-3-ol hydrochloride?

The InChIKey is AQIBIGFECQXVPL-OZZZDHQUSA-N.

What is the Canonical SMILES of trans-4-Cyclopentylamino-1,1-dioxo-tetrahydrothiophen-3-ol hydrochloride?

The Canonical SMILES is C1CCC(C1)NC2CS(=O)(=O)CC2O.Cl.

What is the Isomeric SMILES of trans-4-Cyclopentylamino-1,1-dioxo-tetrahydrothiophen-3-ol hydrochloride?

The Isomeric SMILES is C1CCC(C1)N[C@H]2CS(=O)(=O)C[C@@H]2O.Cl.

What is the heavy atom count of trans-4-Cyclopentylamino-1,1-dioxo-tetrahydrothiophen-3-ol hydrochloride?

The heavy atom count is 15.

Is trans-4-Cyclopentylamino-1,1-dioxo-tetrahydrothiophen-3-ol hydrochloride a canonicalized compound?

Yes, it is a canonicalized compound.

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