CAS
907604-62-0 Purity
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907604-62-0 Purity
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Benzeneacetic acid,a-[(3,5-dinitrobenzoyl)amino]-,(as)-
CAS
90761-62-9
Catalog Number
ACM90761629
Category
Other Products
Molecular Weight
345.26
Molecular Formula
C15H11N3O7
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Specification
Synonyms
S-(+)-N-(3,5-Dinitrobenzoyl)phenylglycine, 90761-62-9, AC1OCXR9, 276294_ALDRICH, MolPort-003-929-007, AKOS015888884, N-3,5-Dinitrobenzoyl-L-phenyl glycine, K806, FT-0642183, N-(3,5-Dinitrobenzoyl)-L-|A-phenylglycine, N-(3,5-Dinitrobenzoyl)-L-alpha-phenylglycine, (S)-(+)-N-(3,5-Dinitrobenzoyl)phenylglycine, (S)-(+)-N-(3,5-Dinitrobenzoyl)-|A-phenylglycine, (S)-(+)-N-(3,5-Dinitrobenzoyl)-alpha-phenylglycine, I01-16726, (2S)-2-[(3,5-dinitrobenzoyl)amino]-2-phenylacetic acid
IUPAC Name
(2S)-2-[(3,5-dinitrobenzoyl)amino]-2-phenylacetic acid
Canonical SMILES
C1=CC=C(C=C1)C(C(=O)O)NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-]
InChI Key
MIVUDAUOXJDARR-ZDUSSCGKSA-N
Boiling Point
569.4ºC at 760mmHg
Melting Point
218-220ºC(lit.)
Flash Point
298.2ºC
Density
1.527g/cm³
Exact Mass
345.06000
H-Bond Acceptor
7
H-Bond Donor
2
Safety Description
S22-S24/25
What is the molecular formula of Benzeneacetic acid, a-[(3,5-dinitrobenzoyl)amino]-,(as)-?
The molecular formula is C15H11N3O7.
What is the molecular weight of Benzeneacetic acid, a-[(3,5-dinitrobenzoyl)amino]-,(as)-?
The molecular weight is 345.26 g/mol.
When was Benzeneacetic acid, a-[(3,5-dinitrobenzoyl)amino]-,(as)- created?
It was created on July 29, 2006.
When was Benzeneacetic acid, a-[(3,5-dinitrobenzoyl)amino]-,(as)- last modified?
It was last modified on December 30, 2023.
What is the IUPAC name of Benzeneacetic acid, a-[(3,5-dinitrobenzoyl)amino]-,(as)-?
The IUPAC name is (2S)-2-[(3,5-dinitrobenzoyl)amino]-2-phenylacetic acid.
What is the InChI of Benzeneacetic acid, a-[(3,5-dinitrobenzoyl)amino]-,(as)-?
The InChI is InChI=1S/C15H11N3O7/c19-14(16-13(15(20)21)9-4-2-1-3-5-9)10-6-11(17(22)23)8-12(7-10)18(24)25/h1-8,13H,(H,16,19)(H,20,21)/t13-/m0/s1.
What is the InChIKey of Benzeneacetic acid, a-[(3,5-dinitrobenzoyl)amino]-,(as)-?
The InChIKey is MIVUDAUOXJDARR-ZDUSSCGKSA-N.
What is the canonical SMILES of Benzeneacetic acid, a-[(3,5-dinitrobenzoyl)amino]-,(as)-?
The canonical SMILES is C1=CC=C(C=C1)C(C(=O)O)NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-].
What is the CAS number of Benzeneacetic acid, a-[(3,5-dinitrobenzoyl)amino]-,(as)-?
The CAS number is 90761-62-9.
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