[CAS NO. 5537-71-3] 3-(1-Cyanoethyl)benzoic acid

Name: 3-(1-Cyanoethyl)benzoic acid
Brand: Arctom Scientific
SKU: HY-Y1416

Ships within

Stock

Price

Qty

Total

$0.00

Please click "REQUEST A QUOTE" button if you need other sizes or custom synthesis

request a quote

If there is no stock, or you need other sizes or custom synthesis, please:

PRODUCTS SPECIFICATIONS [5537-71-3]

Store

Catalog

HY-Y1416

Brand

MCE

CAS

5537-71-3

DESCRIPTION [5537-71-3]

Overview

MDL	MFCD00002520
Molecular Weight	175.18
Molecular Formula	C10H9NO2
SMILES	O=C(O)C1=CC=CC(C(C#N)C)=C1

For research use only. We do not sell to patients.

Summary

3-(1-Cyanoethyl)benzoic acid (DF2107Y) is a benzoic acid that can be used to screen cobalt containing nitrile hydratases (NHases) ^[1] .

Appearance

Solid

Shipping

Room temperature in continental US; may vary elsewhere.

Storage

Powder	-20°C	3 years
	4°C	2 years
In solvent	-80°C	6 months
	-20°C	1 month

Solvent & Solubility

In Vitro:

DMSO : 100 mg/mL ( 570.84 mM ; Need ultrasonic)

Preparing
Stock Solutions

Concentration Solvent Mass	1 mg	5 mg	10 mg

1 mM	5.7084 mL	28.5421 mL	57.0841 mL
5 mM	1.1417 mL	5.7084 mL	11.4168 mL
10 mM	0.5708 mL	2.8542 mL	5.7084 mL

* Please refer to the solubility information to select the appropriate solvent.

In Vivo:

1.

Add each solvent one by one: 10% DMSO >> 40% PEG300 >> 5% Tween-80 >> 45% saline

Solubility: ≥ 2.5 mg/mL (14.27 mM); Clear solution
2.

Add each solvent one by one: 10% DMSO >> 90% (20% SBE-β-CD in saline)

Solubility: ≥ 2.5 mg/mL (14.27 mM); Clear solution
3.

Add each solvent one by one: 10% DMSO >> 90% corn oil

Solubility: ≥ 2.5 mg/mL (14.27 mM); Clear solution

* All of the co-solvents are available by MCE.

References

[1] S van Pelt, et al. Probing the enantioselectivity of a diverse group of purified cobalt-centred nitrile hydratases. Org Biomol Chem. 2011 Apr 21;9(8):3011-9.

Synonyms

Benzoic acid, 3-(1-cyanoethyl)-

Benzoic acid, m-(1-cyanoethyl)-

3-(1-Cyanoethyl)benzoic acid

2-(3-Carboxyphenyl)propionitrile

m-(1-Cyanoethyl)benzoic acid

NSC 113992

DF 2107Y