2- (2,3-Dichlorophenoxy) -2-phenylacetic acid

CAT: 0926-NMB11695-01Size: 250 mgDry Ice: NoHazardous: No

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CAT#:0926-NMB11695-01Size:250 mg

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CAS Number

938116-95-1

MDL Number

MFCD09704702

Smiles

C1=CC=C (C=C1) C (C (=O) O) OC2=C (C (=CC=C2) Cl) Cl

Molecular Formula

C14H10Cl2O3

Molecular Weight

297.1 g/mol

Controlled

Chemical Information

2-(2,3-Dichlorophenoxy)-2-phenylacetic acid

CAS Number	938116-95-1
PubChem CID	20985312
IUPAC Name	2-(2,3-dichlorophenoxy)-2-phenylacetic acid
Molecular Formula	C14H10Cl2O3
Molecular Weight	297.1
XLogP	4.4
Topological Polar Surface Area	46.5
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	4
Heavy Atom Count	19
Formal Charge	0
Complexity	305

SMILES

C1=CC=C(C=C1)C(C(=O)O)OC2=C(C(=CC=C2)Cl)Cl

InChI

InChI=1S/C14H10Cl2O3/c15-10-7-4-8-11(12(10)16)19-13(14(17)18)9-5-2-1-3-6-9/h1-8,13H,(H,17,18)

InChIKey

KVZZXAUDEDBEOL-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 938116-95-1

CID: 20985312

Formula: C14H10Cl2O3

MW: 297.1

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	297.1
XLogP3	4.4
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	4
Exact Mass	296.0006996
Monoisotopic Mass	296.0006996
Topological Polar Surface Area	46.5 Å²
Heavy Atom Count	19
Formal Charge	0
Complexity	305
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
NMB15194-01	2- (3,5-Dichlorophenoxy) -2-phenylacetic acid
NMB36883-01	2- (3,4-Dichlorophenoxy) -2-phenylacetic acid
LJB06547-01	2- (2,5-Dichlorophenoxy) -2-phenylacetic acid
HVB88066-01	2- (3-Chlorobenzenesulfonamido) -2-phenylacetic acid
KCA05052-01	2- (3-Methylbutanamido) -2-phenylacetic acid
NMB28507-01	2- (3-Bromophenoxy) -2-phenylacetic acid
RQB82298-01	2- (3-Methylbutoxy) -2-phenylacetic acid
RQB52075-01	2- (3-Fluorophenoxy) -2-phenylacetic acid
UTB67299-01	2- (3-Formylphenoxy) -2-phenylacetic acid
RBA12819-01	2- (Acetylsulfanyl) -2-phenylacetic acid

Catalog	Name
sc-304907	2- (2,3-Dichlorophenoxy) propanoic acid
sc-339629A	2- (3-bromophenoxy) -2-phenylacetic acid
OR1101853-01	2- (3-Formylphenoxy) -2-phenylacetic acid
CS-M-17761	(2,3-Dichlorophenoxy) acetic acid
sc-298723	3- (2-Fluorobenzyloxy) phenylacetic acid
sc-344245A	3- (2,3-dichlorophenoxy) propanoic acid
418470-01	2-Isopropoxy-2-phenylacetic acid
sc-343161A	2-phenoxy-2-phenylacetic acid
TRC-B695755-2.5G	2-Bromo-2-phenylacetic Acid
OR907811-01	2-Chloro-2-phenylacetic acid