Carbarsone

CAT: 0127-OR1079525-02Size: 250 mgDry Ice: NoHazardous: No

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CAT#:0127-OR1079525-02Size:250 mg

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

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CAS Number

121-59-5

Purity

98%

Smiles

C1=CC (=CC=C1NC (=O) N) [As] (=O) (O) O

Chemical Information

Carbarsone

[4-(carbamoylamino)phenyl]arsonic acid is a member of ureas.

CAS Number	121-59-5
PubChem CID	8480
IUPAC Name	[4-(carbamoylamino)phenyl]arsonic acid
Molecular Formula	C7H9AsN2O4
Molecular Weight	260.08
Topological Polar Surface Area	113
Hydrogen Bond Donor Count	4
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	2
Heavy Atom Count	14
Formal Charge	0
Complexity	256

SMILES

C1=CC(=CC=C1NC(=O)N)[As](=O)(O)O

InChI

InChI=1S/C7H9AsN2O4/c9-7(11)10-6-3-1-5(2-4-6)8(12,13)14/h1-4H,(H3,9,10,11)(H2,12,13,14)

InChIKey

WWXBHTZSYYGCSG-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 121-59-5

CID: 8480

Formula: C7H9AsN2O4

MW: 260.08

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	260.08
Hydrogen Bond Donor Count	4
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	2
Exact Mass	259.977826
Monoisotopic Mass	259.977826
Topological Polar Surface Area	113 Å²
Heavy Atom Count	14
Formal Charge	0
Complexity	256
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
BUP00638-01	Carabrone

Catalog	Name
HY-121067	Carbarsone