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Brc1cnc(nc1)C
Pyrimidine, 5-bromo-2-methyl-
CCCP1(=O)OP(=O)(CCC)OP(=O)(O1)CCC
1,3,5,2,4,6-Trioxatriphosphorinane, 2,4,6-tripropyl-, 2,4,6-trioxide
CC1(C)OB(OC1(C)C)B1OC(C(O1)(C)C)(C)C
2,2'-Bi-1,3,2-dioxaborolane, 4,4,4',4',5,5,5',5'-octamethyl-
O=C(C=Cc1ccccc1)C=Cc1ccccc1.O=C(C=Cc1ccccc1)C=Cc1ccccc1.O=C(C=Cc1ccccc1)C=Cc1ccccc1.[Pd].[Pd]
Tris(dibenzylideneacetone)dipalladium
C1CCC(CC1)P(C1CCCCC1)C1CCCCC1.Cc1cc(C)c(c(c1)C)N1CCN(C1=[Ru](=Cc1ccccc1)(Cl)Cl)c1c(C)cc(cc1C)C
Ruthenium,[1,3-bis(2,4,6-trimethylphenyl)-2-imidazolidinylidene]dichloro(phenylmethylene)(tricyclohexylphosphine)-, (SP-5-41)-

methyl 4-amino-3,5-dichlorobenzoate

COC(=O)c1cc(Cl)c(c(c1)Cl)N Request for Quotation
Chemical Name: methyl 4-amino-3,5-dichlorobenzoate
CAS Number: 41727-48-4
Product Number: AG00CLMQ(AGN-PC-0JTNMY)
Synonyms:
MDL No:
Molecular Formula: C8H7Cl2NO2
Molecular Weight: 220.0527

Identification/Properties

Computed Properties
Molecular Weight:
220.049g/mol
XLogP3:
2.9
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
2
Exact Mass:
218.985g/mol
Monoisotopic Mass:
218.985g/mol
Topological Polar Surface Area:
52.3A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
189
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information

GHS Pictogram:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum

Other Analytical Data

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Chemical Structure


Methyl 4-amino-3,5-dichlorobenzoate is a versatile compound widely utilized in chemical synthesis processes. It serves as a key intermediate for the preparation of various pharmaceuticals, agrochemicals, and specialized materials. This compound offers a strategic building block with reactive sites that can be effectively functionalized to introduce diverse chemical functionalities. Its unique structure imparts specific properties that make it valuable for designing and synthesizing complex organic molecules. In the realm of chemical synthesis, Methyl 4-amino-3,5-dichlorobenzoate plays a crucial role in enabling the creation of novel compounds with tailored structures and desired properties. Its versatility and compatibility with a range of synthetic methodologies make it a valuable asset in organic chemistry research and industry applications.