7-Hydroxy Coumarin-13C6

CAT: 0024-sc-217442Size: 1 mgDry Ice: NoHazardous: No

1 / 1

CAT#:0024-sc-217442Size:1 mg

Selected

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

Quick Request Actions

CAS Number

1189992-05-9

Chemical Information

7-Hydroxy Coumarin-13C6

CAS Number	1189992-05-9
PubChem CID	46781768
IUPAC Name	7-hydroxychromen-2-one
Molecular Formula	C9H6O3
Molecular Weight	168.10
XLogP	1.6
Topological Polar Surface Area	46.5
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	0
Heavy Atom Count	12
Formal Charge	0
Complexity	222

SMILES

C1=C[13C]2=[13C]([13CH]=[13C]([13CH]=[13CH]2)O)OC1=O

InChI

InChI=1S/C9H6O3/c10-7-3-1-6-2-4-9(11)12-8(6)5-7/h1-5,10H/i1+1,3+1,5+1,6+1,7+1,8+1

InChIKey

ORHBXUUXSCNDEV-AMPMUIAWSA-N

Chemical Structure

2D Structure

CAS: 1189992-05-9

CID: 46781768

Formula: C9H6O3

MW: 168.10

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	168.10
XLogP3	1.6
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	0
Exact Mass	168.05182306
Monoisotopic Mass	168.05182306
Topological Polar Surface Area	46.5 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	222
Isotope Atom Count	6
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
sc-490281	7-Hydroxy Coumarin-d5
sc-210622A	7-Hydroxy-4- (trifluoromethyl) coumarin
sc-210622	7-Hydroxy-4- (trifluoromethyl) coumarin
sc-268402	7-Hydroxy-4- (methoxymethyl) coumarin
sc-319730A	7-Hydroxy-4- (3-trifluoromethylphenyl) coumarin
sc-217440	7-Hydroxy Coumarin Sulfate Potassium Salt
sc-319730	7-Hydroxy-4- (3-trifluoromethylphenyl) coumarin
sc-252640	Coumarin 7
sc-319731	7-Hydroxy-4- (pyridin-3-yl) coumarin
sc-319731A	7-Hydroxy-4- (pyridin-3-yl) coumarin

Catalog	Name
TRC-H924878-1MG	7-Hydroxy Coumarin-13C6
HY-W766332	7-Hydroxy coumarin glucuronide (sodium) -13C6
TRC-H924892-2.5MG	7-Hydroxy Coumarin-13C6 Sulfate Potassium Salt
MBS6069407-01	7-Hydroxy Coumarin
TRC-H924883-10MG	7-Hydroxy Coumarin-13C6 Beta-D-Glucuronide Sodium Salt
439691-01	7-Hydroxy Coumarin-d5
013599	7-Hydroxy Coumarin-13C3
MBS6102937-01	7-Hydroxy Coumarin Sulfate
PXB99205-01	7-Hydroxy coumarin-13C
HY-120201-01	7-Hydroxy coumarin glucuronide (sodium)