Name: Name:methyl 3-chloro-4-hydroxyphenylacetate
Brand: Angene
SKU: AG00EARQ
Rating: 90 (10 reviews)

methyl 3-chloro-4-hydroxyphenylacetate

CAS No.:

57017-95-5

Catalog Number:

AG00EARQ

Molecular Formula:

C9H9ClO3

Molecular Weight:

200.6190

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Product Description

Catalog Number:

AG00EARQ

Chemical Name:

methyl 3-chloro-4-hydroxyphenylacetate

CAS Number:

57017-95-5

Molecular Formula:

C9H9ClO3

Molecular Weight:

200.6190

MDL Number:

MFCD00209663

IUPAC Name:

methyl 2-(3-chloro-4-hydroxyphenyl)acetate

InChI:

InChI=1S/C9H9ClO3/c1-13-9(12)5-6-2-3-8(11)7(10)4-6/h2-4,11H,5H2,1H3

InChI Key:

ACBFEXJHCINJDS-UHFFFAOYSA-N

SMILES:

COC(=O)Cc1ccc(c(c1)Cl)O

EC Number:

260-514-8

Properties

Complexity:

184

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

200.024g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

200.618g/mol

Monoisotopic Mass:

200.024g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

46.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

Literature

Title	Journal
Carbonic anhydrase inhibitors. Identification of selective inhibitors of the human mitochondrial isozymes VA and VB over the cytosolic isozymes I and II from a natural product-based phenolic library.	Bioorganic & medicinal chemistry 20100101

Properties