Products for Research Use Only
RegisterLogin

Thalassotalic Acid C

CAT: 0572-TRC-T186020-250MGSize: 250 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0572-TRC-T186020-250MGSize:250 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
1867136-50-2
Hazard Statement
No Data Available
Smiles
CCCCCCCCC(=O)N\C(=C/c1ccc(O)cc1)\C(=O)O
Molecular Formula
C18 H25 N O4
Molecular Weight
319.395
InChI
InChI=1S/C18H25NO4/c1-2-3-4-5-6-7-8-17(21)19-16(18(22)23)13-14-9-11-15(20)12-10-14/h9-13,20H,2-8H2,1H3,(H,19,21)(H,22,23)/b16-13-
Additionnal Information
IUPAC name: (Z)-3-(4-hydroxyphenyl)-2-(nonanoylamino)prop-2-enoic acid
Shipping Conditions
Room Temperature

Chemical Information

Thalassotalic acid C

Thalabetaotalic acid C is a N-acyl-amino acid.

CAS Number1867136-50-2
PubChem CID127051306
IUPAC Name(Z)-3-(4-hydroxyphenyl)-2-(nonanoylamino)prop-2-enoic acid
Molecular FormulaC18H25NO4
Molecular Weight319.4
XLogP4.4
Topological Polar Surface Area86.6
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count10
Heavy Atom Count23
Formal Charge0
Complexity398
SMILES
CCCCCCCCC(=O)N/C(=C\C1=CC=C(C=C1)O)/C(=O)O
InChI
InChI=1S/C18H25NO4/c1-2-3-4-5-6-7-8-17(21)19-16(18(22)23)13-14-9-11-15(20)12-10-14/h9-13,20H,2-8H2,1H3,(H,19,21)(H,22,23)/b16-13-
InChIKey
AHZLBFGDTXIKKL-SSZFMOIBSA-N
Chemical Structure
2D Structure
2D structure of Thalassotalic acid C
CAS: 1867136-50-2
CID: 127051306
Formula: C18H25NO4
MW: 319.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight319.4
XLogP34.4
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count10
Exact Mass319.17835828
Monoisotopic Mass319.17835828
Topological Polar Surface Area86.6 Ų
Heavy Atom Count23
Formal Charge0
Complexity398
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
TRC-T186000-250MGThalassotalic Acid A
TRC-T186010-500MGThalassotalic Acid B
TRC-P839530-100MGPseudomonic Acid C
TRC-P839530-10MGPseudomonic Acid C
A771310Aristolochic Acid C
TRC-S100825-100MGSalvianolic Acid C
TRC-P361171-50MGPhenylpyruvic Acid-¹³C₆
TRC-I389310-25MG3-Iodothyroacetic Acid-¹³C₆
S624120C.I. Acid Orange 6 (Free Acid)
TRC-C217330-1GC.I. Acid Green 41

Alternative Products

CatalogName
SZC13649Thalassotalic acid B
OR1071368-01Acid-apeg6-acid
MBS6083807-01Medronic Acid (Methylenebiphosphonic Acid, Methylenediphosphonic Acid, Methanebisphosphonic Acid, Methanediphosphonic Acid, MDP)
L2500-01Lipoic Acid (Thioctic Acid, (±) -α-Lipoic Acid)
041005Cacodylic Acid (dimethylarsonic acid, dimethylarsinic acid)
MBS641082-01Lipoic Acid (Thioctic Acid, Alpha Lipoic Acid)
O8099-01Oxalacetic Acid (Oxaloacetic acid)
275335-01Ethylenediaminediacetic acid dipropionic acid
MBS6036559-01a-Lipoic Acid (Thioctic Acid)
MBS651473-01Ambuic acid ((+)-Ambuic acid)

Popular Products