Structure

Fast Red ITR

CAS
97-35-8
Catalog Number
ACM97358
Category
Azoic Dyes
Molecular Weight
258.34
Molecular Formula
C11H18N2O3S

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Specification

Synonyms
Red ITR base, Fast Red ITR Base, Fast Red ITR, Orle Base Fast Red ITR, Azoic Diazo No. 42, Brentamine Fast Red ITR Base, MLS000776114, Azoic diazo component 42, base, N1,N1-Diethyl-4-methoxymetanilamide, 2-Methoxy-5-(diethylsulfamoyl)aniline, 201286_SIAL, NSC50670, EINECS 202-575-5, NSC 50670, ZINC04506033, 2-Methoxy-5-(diethylaminosulfonyl)aniline, C.I. 37150, 2-Methoxyaniline-5-sulfonic acid diethylamide, Metanilamide, N1,N1-diethyl-4-methoxy-, SMR000371124
IUPAC Name
3-amino-N,N-diethyl-4-methoxybenzenesulfonamide
InChI Key
WBGVVXSCGNGJFL-UHFFFAOYSA-N
Boiling Point
410.6ºC at 760mmHg
Melting Point
102-105ºC
Flash Point
202.1ºC
Density
1.205g/cm³
Appearance
White uniform powder
Exact Mass
258.10400
Hazard Statements
F,T,N
H-Bond Acceptor
5
H-Bond Donor
1
Packing Group
I
Safety Description
S53:Avoid exposure - obtain special instruction before use .
S9:Keep container in a well-ventilated place .
S16:Keep away from sources of ignition - No smoking .
S45:In case of accident or if you feel unwell, seek medical advice immediately (show label wh
WGK Germany
3
What is the molecular formula of Fast Red ITR?

The molecular formula of Fast Red ITR is C11H18N2O3S.

What is the molecular weight of Fast Red ITR?

The molecular weight of Fast Red ITR is 258.34 g/mol.

What is the IUPAC name of Fast Red ITR?

The IUPAC name of Fast Red ITR is 3-amino-N,N-diethyl-4-methoxybenzenesulfonamide.

What is the InChIKey of Fast Red ITR?

The InChIKey of Fast Red ITR is WBGVVXSCGNGJFL-UHFFFAOYSA-N.

What is the canonical SMILES of Fast Red ITR?

The canonical SMILES of Fast Red ITR is CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)OC)N.

What is the CAS number of Fast Red ITR?

The CAS number of Fast Red ITR is 97-35-8.

What is the EC number of Fast Red ITR?

The EC number of Fast Red ITR is 202-575-5.

What is the UNII of Fast Red ITR?

The UNII of Fast Red ITR is JX9EQ4DY8G.

What is the ChEMBL ID of Fast Red ITR?

The ChEMBL ID of Fast Red ITR is CHEMBL1409972.

What is the XLogP3 value of Fast Red ITR?

The XLogP3 value of Fast Red ITR is 1.7.

How many hydrogen bond donor counts does Fast Red ITR have?

Fast Red ITR has 1 hydrogen bond donor count.

How many hydrogen bond acceptor counts does Fast Red ITR have?

Fast Red ITR has 5 hydrogen bond acceptor counts.

How many rotatable bond counts does Fast Red ITR have?

Fast Red ITR has 5 rotatable bond counts.

What is the exact mass of Fast Red ITR?

The exact mass of Fast Red ITR is 258.10381361 g/mol.

What is the topological polar surface area of Fast Red ITR?

The topological polar surface area of Fast Red ITR is 812.

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