Benzoic acid, 2-amino-4-chloro-

Name: Benzoic acid, 2-amino-4-chloro-
Brand: ChemScene
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CAS No. 89-77-0
Cat. No. CS-0654083
Purity≥98%
MDL No.None

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Type	HazMat Fee
Excepted Quantity	$0.00
FedEx Limited Quantities Ground	$0.00
Hazmat Ground shipping	$50.00+
Inaccessible (Haz class 6.1 or 9), Domestic	$68.00+
Accessible (Haz class 3, 4, 5 or 8), Domestic	$158.00+
Inaccessible (Haz class 6.1 or 9), International	$108.00+
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Benzoic acid, 2-amino-4-chloro-|CS-0654083

Structure of 89-77-0

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General Information

CAS No. 89-77-0
Cat. No. CS-0654083
Purity ≥98%
MDL No. None
Storage Sealed in dry,2-8℃
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₇H₆ClNO₂
Molecular Weight 171.58
Synonym(s) None
SMILES O=C(O)C1=CC=C(Cl)C=C1N

Synthesis

Route1
- 50-84-0
- ~87%
- 89-77-0
References
- Yakhontov, L. N.; Zhikhareva, G. P.; Mastafanova, L. I.; Evstratova, M. I.; Pershin, G. N.; et al. Pharmaceutical Chemistry Journal, 1987 , vol. 21, # 1 p. 34 - 45 Khimiko-Farmatsevticheskii Zhurnal, 1987 , vol. 21, # 1 p. 38 - 49
Route2
- In-stock
  
  6280-88-2
- ~%
- 89-77-0
References
- Journal of the American Chemical Society, , vol. 76, p. 6336,6337
Route3
- 66909-52-2
- ~65%
- 89-77-0
References
- Yakhontov, L. N.; Zhikhareva, G. P.; Mastafanova, L. I.; Evstratova, M. I.; Pershin, G. N.; et al. Pharmaceutical Chemistry Journal, 1987 , vol. 21, # 1 p. 34 - 45 Khimiko-Farmatsevticheskii Zhurnal, 1987 , vol. 21, # 1 p. 38 - 49

Safety Information

Download SDS

GHS Pictogram :	GHS No : GHS07
Signal Word : Warning	UN#: N/A
Class : N/A	Packing Group : N/A
Hazard Statements : H315-H319-H335
Precautionary Statements : P261-P264-P271-P280-P302+P352-P304+P340-P362+P364-P405-P501

Quality Control

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Computational Chemistry Data

TPSA 63.32
LogP 1.6204
H_Acceptors 2
H_Donors 2
Rotatable_Bonds 1

Other Classifications

Building Blocks Functional Group Chloride

Building Blocks Functional Group Carboxylic Acid

Analytical Science Drug Impurity Reference Substance Other Drugs Other impurity

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

Chemical Biology Pharmaceutical Development and Drug Discovery Research Reagents Peptide Chemistry Unnatural Amino Acid Derivatives

Chemical Biology Pharmaceutical Development and Drug Discovery Research Peptide Chemistry Unnatural Amino Acid Derivatives

Chemical Synthesis Synthetic Reagents Aryne Precursors, Heteroaryne Precursors Benzyne Precursors

Key Words

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Benzoic acid, 2-amino-4-chloro-

CAS No. 89-77-0

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