Fruquintinib Impurity 8

CAT: 1299-RM-F182108-01Size: 10 mgDry Ice: NoHazardous: No

1 / 1

CAT#:1299-RM-F182108-01Size:10 mg

Selected

24/48H Stock Items & 2 to 6 Weeks non Stock Items.

Quick Request Actions

CAS Number

20323-74-4

Synonyms

Ethyl 2-amino-4,5-dimethoxybenzoate

Molecular Formula

C11H15NO4

Molecular Weight

225.24

Target Alternative Name

Fruquintinib

Product Name Synonym

Ethyl 2-amino-4,5-dimethoxybenzoate

Chemical Information

Ethyl 2-amino-4,5-dimethoxybenzoate

CAS Number	20323-74-4
PubChem CID	88488
IUPAC Name	ethyl 2-amino-4,5-dimethoxybenzoate
Molecular Formula	C11H15NO4
Molecular Weight	225.24
XLogP	2
Topological Polar Surface Area	70.8
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	5
Heavy Atom Count	16
Formal Charge	0
Complexity	234

SMILES

CCOC(=O)C1=CC(=C(C=C1N)OC)OC

InChI

InChI=1S/C11H15NO4/c1-4-16-11(13)7-5-9(14-2)10(15-3)6-8(7)12/h5-6H,4,12H2,1-3H3

InChIKey

SMICMEHDDWELMR-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 20323-74-4

CID: 88488

Formula: C11H15NO4

MW: 225.24

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	225.24
XLogP3	2
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	5
Exact Mass	225.10010796
Monoisotopic Mass	225.10010796
Topological Polar Surface Area	70.8 Å²
Heavy Atom Count	16
Formal Charge	0
Complexity	234
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