Products for Research Use Only
RegisterLogin

Dihydrosenkyunolide C

CAT: 0931-TN5817Size: 5 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0931-TN5817Size:5 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
195142-72-4
Bioactivity
Dihydrosenkyunolide C is a natural product for research related to life sciences. The catalog number is TN5817 and the CAS number is 195142-72-4.
Smiles
CCCCC(c1c2ccc(O)c1)OC2=O
Molecular Formula
C12H14O3
Molecular Weight
206.24
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

3-Butyl-5-hydroxyphthalide
CAS Number195142-72-4
PubChem CID73052271
IUPAC Name3-butyl-5-hydroxy-3H-2-benzofuran-1-one
Molecular FormulaC12H14O3
Molecular Weight206.24
XLogP2.4
Topological Polar Surface Area46.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Heavy Atom Count15
Formal Charge0
Complexity239
SMILES
CCCCC1C2=C(C=CC(=C2)O)C(=O)O1
InChI
InChI=1S/C12H14O3/c1-2-3-4-11-10-7-8(13)5-6-9(10)12(14)15-11/h5-7,11,13H,2-4H2,1H3
InChIKey
QWUKGYMMZPJSKL-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 3-Butyl-5-hydroxyphthalide
CAS: 195142-72-4
CID: 73052271
Formula: C12H14O3
MW: 206.24
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight206.24
XLogP32.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Exact Mass206.094294304
Monoisotopic Mass206.094294304
Topological Polar Surface Area46.5 Ų
Heavy Atom Count15
Formal Charge0
Complexity239
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
T14849-01C-NH-Boc-C-Bis- (C-PEG1-Boc)
T41069-01CHO-C-PEG2-C-CHO
T87513-01Thalidomide-azetidine-C-PIP-C-boc
TN11169-01Levinoid C
TN4897Rauvotetraphylline C
T78484-01Xanthohumol C
TN6196Buxifoliadine C
TN5256Wilforol C
T125850-01Schisanlignone C
TN4208Heteroclitin C

Alternative Products

CatalogName
GTR19179629-01Dihydrosenkyunolide C

Popular Products