4-Aminophenyl acetate HCl

CAT: 0926-NAA87168-01Size: 5000 mgDry Ice: NoHazardous: No

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CAT#:0926-NAA87168-01Size:5000 mg

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CAS Number

13871-68-6

MDL Number

MFCD08691414

Smiles

CC (=O) OC1=CC=C (C=C1) N

Molecular Formula

C8H10ClNO2

Molecular Weight

187.62 g/mol

Controlled

Chemical Information

Phenol, 4-amino-, 1-acetate

CAS Number	13871-68-6
PubChem CID	83783
IUPAC Name	(4-aminophenyl) acetate
Molecular Formula	C8H9NO2
Molecular Weight	151.16
XLogP	0.4
Topological Polar Surface Area	52.3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	2
Heavy Atom Count	11
Formal Charge	0
Complexity	139

SMILES

CC(=O)OC1=CC=C(C=C1)N

InChI

InChI=1S/C8H9NO2/c1-6(10)11-8-4-2-7(9)3-5-8/h2-5H,9H2,1H3

InChIKey

QVJWBJWRAPJXNM-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 13871-68-6

CID: 83783

Formula: C8H9NO2

MW: 151.16

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	151.16
XLogP3	0.4
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	2
Exact Mass	151.063328530
Monoisotopic Mass	151.063328530
Topological Polar Surface Area	52.3 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	139
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

Catalog	Name
MA04448-01	4-Aminophenyl b-D-thiomannopyranoside HCl
MA05305-01	4-Aminophenyl b-D-mannopyranoside HCl
FWB08567-01	Methyl 2-[4- (4-aminophenyl) piperazin-1-yl]acetate
EFC35336-01	3- (3-Aminophenyl) propyl acetate
QCB99522-01	2- (3-Aminophenyl) ethyl acetate
PCA46085	Ethyl 2- (2-aminophenyl) acetate
FM140568-01	Methyl 2- (2-aminophenyl) acetate
MA04482-01	4-Aminophenyl 2-acetamido-2-deoxy-a-D-galactopyranoside HCl
EJB22190	2-[ (2-Aminophenyl) amino]ethanol HCl
AAA06188	Ethyl 2- (2-aminophenyl) acetate hydrochloride

Catalog	Name
RG-P022723-01	4-Aminophenyl Acetate
sc-281547	Methyl- (4-aminophenyl) acetate
RG-E242617-01	3-aminophenyl acetate
sc-280961	Methyl {[ (4-aminophenyl) sulfonyl]amino}acetate
GTR19276269-01	Tert-Butyl 2- (4-aminophenyl) acetate
sc-353762	Methyl 2-[1- (4-aminophenyl) acetamido]acetate
OR92353-01	Ethyl 2- (3-aminophenyl) acetate
OR1062290	Ethyl 2- (3- (4-aminophenyl) oxetan-3-yl) acetate
TRC-B750870-500MG	tert-Butyl 2-(3-Aminophenyl)acetate
OR91567-01	Methyl 2- (2-aminophenyl) acetate hydrochloride