Products for Research Use Only
RegisterLogin

3-Heptenoic acid

CAT: 0931-TCL-00177-01Size: 100 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0931-TCL-00177-01Size:100 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
29901-85-7
Bioactivity
3-Heptenoic acid is an organic compound classified as an unsaturated fatty acid. It emits a strong, unpleasant odor and is commonly found in various foods, such as beer and dairy products. In the fragrance and flavor industry, 3-Heptenoic acid is widely used as an aroma and flavoring agent in products like perfumes, colognes, and food additives. Additionally, it serves as an intermediate in the synthesis of various chemicals and pharmaceuticals.
Smiles
CCCC=CCC(O)=O
Molecular Formula
C7H12O2
Molecular Weight
128.17
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Hept-3-enoic acid
CAS Number29901-85-7
PubChem CID6434067
IUPAC Name(Z)-hept-3-enoic acid
Molecular FormulaC7H12O2
Molecular Weight128.17
XLogP1.7
Topological Polar Surface Area37.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count4
Heavy Atom Count9
Formal Charge0
Complexity105
SMILES
CCC/C=C\CC(=O)O
InChI
InChI=1S/C7H12O2/c1-2-3-4-5-6-7(8)9/h4-5H,2-3,6H2,1H3,(H,8,9)/b5-4-
InChIKey
BCYXFRMDZWKZSF-PLNGDYQASA-N
Chemical Structure
2D Structure
2D structure of Hept-3-enoic acid
CAS: 29901-85-7
CID: 6434067
Formula: C7H12O2
MW: 128.17
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight128.17
XLogP31.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count4
Exact Mass128.083729621
Monoisotopic Mass128.083729621
Topological Polar Surface Area37.3 Ų
Heavy Atom Count9
Formal Charge0
Complexity105
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
TYD-00681-012-Heptenoic acid
T77548-01(6Z) -7-Phenyl-7- (3-Pyridinyl) -6-Heptenoic Acid
TYD-01973-016-Heptynoic acid
T65305Heptanoic acid methyl ester
T71970-01Fmoc-7-amino-heptanoic acid
TN9211-013,3-Dimethylbutyric acid
T7464-013,3-Dimethylglutaric acid
TYD-02032-013,3'-Azanediyldipropanoic acid
T390533,3-Dibromopropenoic acid
TYD-00597-013,3',3''-Nitrilotripropionic Acid

Alternative Products

CatalogName
sc-2891593-Heptenoic Acid
HY-W107869-012-Heptenoic acid
OR937178-016-Heptenoic acid
FH184101-01(6R) -6-Hydroxy-3-heptenoic acid
TAA77690-01(5E) -5-Heptenoic acid
ZAA28645-016-Methyl-5-heptenoic acid
TRC-B693455-25MG2-tert-Butyloxycarbonylamino-5-heptenoic Acid
1593872-Amino-6-heptenoic Acid Hydrochloride
TRC-H523920-500MG(Z)-2-Heptenoic Acid Butyl Ester
MBS9022508-01(2R)-2-(Boc-amino)-6-heptenoic acid

Popular Products