Benzenepropanamide,a-amino-4-hydroxy-N-(4-methyl-2-oxo-2H-1-benzopyran-7-yl)-,(as)-

Name: Benzenepropanamide,a-amino-4-hydroxy-N-(4-methyl-2-oxo-2H-1-benzopyran-7-yl)-,(as)-
SKU: ACM94099577
Rating: 5 (1 reviews)

CAS

94099-57-7

Catalog Number

ACM94099577

Category

Other Products

Molecular Weight

452.38

Molecular Formula

C₁₉H₁₈N₂O₄

COA MSDS SDS Spec Sheet

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Specification

Synonyms

L-Tyrosine 7-amido-4-methylcoumarin, AC1OLRVE, T2141_SIGMA, T-9100, (2S)-2-amino-3-(4-hydroxyphenyl)-N-(4-methyl-2-oxochromen-7-yl)propanamide, 94099-57-7

IUPAC Name

(2S)-2-amino-3-(4-hydroxyphenyl)-N-(4-methyl-2-oxochromen-7-yl)propanamide

SMILES

CC1=CC(=O)OC2=C1C=CC(=C2)NC(=O)C(CC3=CC=C(C=C3)O)N.C(=O)(C(F)(F)F)O

InChI Key

NRGJYQDVMUOJLU-INIZCTEOSA-N

Boiling Point

644ºC at 760 mmHg

Flash Point

343.3ºC

Density

1.365g/cm³

Exact Mass

338.12700

H-Bond Acceptor

H-Bond Donor

WGK Germany

What is the molecular formula of Benzenepropanamide,a-amino-4-hydroxy-N-(4-methyl-2-oxo-2H-1-benzopyran-7-yl)-,(as)-?

The molecular formula is C19H18N2O4.

What are some synonyms for Benzenepropanamide,a-amino-4-hydroxy-N-(4-methyl-2-oxo-2H-1-benzopyran-7-yl)-,(as)-?

Some synonyms include L-Tyrosine 7-amido-4-methylcoumarin, H-Tyr-AMC, and others listed in the reference.

What is the molecular weight of Benzenepropanamide,a-amino-4-hydroxy-N-(4-methyl-2-oxo-2H-1-benzopyran-7-yl)-,(as)-?

The molecular weight is 338.4 g/mol.

When was Benzenepropanamide,a-amino-4-hydroxy-N-(4-methyl-2-oxo-2H-1-benzopyran-7-yl)-,(as)- created in PubChem?

It was created on July 29, 2006.

What is the InChIKey for Benzenepropanamide,a-amino-4-hydroxy-N-(4-methyl-2-oxo-2H-1-benzopyran-7-yl)-,(as)-?

The InChIKey is NRGJYQDVMUOJLU-INIZCTEOSA-N.

How many hydrogen bond donor counts does Benzenepropanamide,a-amino-4-hydroxy-N-(4-methyl-2-oxo-2H-1-benzopyran-7-yl)-,(as)- have?

It has 3 hydrogen bond donor counts.

What is the topological polar surface area of Benzenepropanamide,a-amino-4-hydroxy-N-(4-methyl-2-oxo-2H-1-benzopyran-7-yl)-,(as)-?

The topological polar surface area is 102 Å2.

How many defined atom stereocenter counts does Benzenepropanamide,a-amino-4-hydroxy-N-(4-methyl-2-oxo-2H-1-benzopyran-7-yl)-,(as)- have?

It has 1 defined atom stereocenter count.

Is Benzenepropanamide,a-amino-4-hydroxy-N-(4-methyl-2-oxo-2H-1-benzopyran-7-yl)-,(as)- a canonicalized compound?

Yes, it is a canonicalized compound.

What is the XLogP3 value of Benzenepropanamide,a-amino-4-hydroxy-N-(4-methyl-2-oxo-2H-1-benzopyran-7-yl)-,(as)-?

The XLogP3 value is 2.2.

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