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Structure

(S)-2,6-Dimethyltyrosine methyl esterhydrochloride

CAS
928138-99-2
Catalog Number
ACM928138992
Category
Other Products
Molecular Formula
C12H18ClNO3

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Specification

Synonyms
(S)-2,6-Dimethyltyrosine methyl ester hydrochloride
What is the molecular formula of (S)-2,6-Dimethyltyrosine methyl ester hydrochloride?

The molecular formula is C12H18ClNO3.

What is the molecular weight of (S)-2,6-Dimethyltyrosine methyl ester hydrochloride?

The molecular weight is 259.73 g/mol.

What is the IUPAC Name of (S)-2,6-Dimethyltyrosine methyl ester hydrochloride?

The IUPAC Name is methyl (2S)-2-amino-3-(4-hydroxy-2,6-dimethylphenyl)propanoate.

What is the InChI of (S)-2,6-Dimethyltyrosine methyl ester hydrochloride?

The InChI is InChI=1S/C12H17NO3.ClH/c1-7-4-9(14)5-8(2)10(7)6-11(13)12(15)16-3;/h4-5,11,14H,6,13H2,1-3H3;1H/t11-/m0./s1.

What is the Canonical SMILES of (S)-2,6-Dimethyltyrosine methyl ester hydrochloride?

The Canonical SMILES is CC1=CC(=CC(=C1CC(C(=O)OC)N)C)O.Cl.

How many hydrogen bond donor counts are there in (S)-2,6-Dimethyltyrosine methyl ester hydrochloride?

There are 3 hydrogen bond donor counts.

What is the topological polar surface area of (S)-2,6-Dimethyltyrosine methyl ester hydrochloride?

The topological polar surface area is 72.6 Ų.

Is the compound canonicalized?

Yes, the compound is canonicalized.

How many rotatable bond counts are there in (S)-2,6-Dimethyltyrosine methyl ester hydrochloride?

There are 4 rotatable bond counts.

What is the Isotope Atom Count of (S)-2,6-Dimethyltyrosine methyl ester hydrochloride?

The Isotope Atom Count is 0.

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