CAS
94231-81-9 Purity
96%
94231-81-9 Purity
96%
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Methyl[7-hydroxy-8-[(2-hydroxy-4-nitrophenyl)azo]-1-naphthyl]-carbamate
CAS
94231-84-2
Catalog Number
ACM94231842
Category
Other Products
Molecular Weight
382.326960 [g/mol]
Molecular Formula
C18H14N4O6
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Specification
Synonyms
EINECS 303-906-7, Methyl (7-hydroxy-8-((2-hydroxy-4-nitrophenyl)azo)-1-naphthyl)-carbamate, 94231-84-2
IUPAC Name
methyl N-[(8Z)-8-[(2-hydroxy-4-nitrophenyl)hydrazinylidene]-7-oxonaphthalen-1-yl]carbamate
Canonical SMILES
COC(=O)NC1=CC=CC2=C1C(=NNC3=C(C=C(C=C3)[N+](=O)[O-])O)C(=O)C=C2
InChI Key
YBHCSSMUMSBTJF-HEHNFIMWSA-N
EC Number
303-906-7
H-Bond Acceptor
8
H-Bond Donor
3
What is the molecular formula of Methyl[7-hydroxy-8-[(2-hydroxy-4-nitrophenyl)azo]-1-naphthyl]-carbamate?
The molecular formula is C18H14N4O6.
When was Methyl[7-hydroxy-8-[(2-hydroxy-4-nitrophenyl)azo]-1-naphthyl]-carbamate created?
It was created on 2019-01-15.
What is the IUPAC name of Methyl[7-hydroxy-8-[(2-hydroxy-4-nitrophenyl)azo]-1-naphthyl]-carbamate?
The IUPAC name is methyl N-[7-hydroxy-8-[(2-hydroxy-4-nitrophenyl)diazenyl]naphthalen-1-yl]carbamate.
What is the InChI key of Methyl[7-hydroxy-8-[(2-hydroxy-4-nitrophenyl)azo]-1-naphthyl]-carbamate?
The InChI key is SVYDTVMSLRWKLE-UHFFFAOYSA-N.
How many hydrogen bond donor counts does Methyl[7-hydroxy-8-[(2-hydroxy-4-nitrophenyl)azo]-1-naphthyl]-carbamate have?
It has 3 hydrogen bond donor counts.
What is the XLogP3-AA value for Methyl[7-hydroxy-8-[(2-hydroxy-4-nitrophenyl)azo]-1-naphthyl]-carbamate?
The XLogP3-AA value is 3.6.
What is the molecular weight of Methyl[7-hydroxy-8-[(2-hydroxy-4-nitrophenyl)azo]-1-naphthyl]-carbamate?
The molecular weight is 382.3 g/mol.
Is Methyl[7-hydroxy-8-[(2-hydroxy-4-nitrophenyl)azo]-1-naphthyl]-carbamate a canonical compound?
Yes, it is a canonical compound.
How many hydrogen bond acceptor counts does Methyl[7-hydroxy-8-[(2-hydroxy-4-nitrophenyl)azo]-1-naphthyl]-carbamate have?
It has 8 hydrogen bond acceptor counts.
What is the synthetic route identifier (CAS) for Methyl[7-hydroxy-8-[(2-hydroxy-4-nitrophenyl)azo]-1-naphthyl]-carbamate?
The synthetic route identifier is CAS 94231-84-2.
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