6-Heptenoic acid - CAS 1119-60-4
Catalog:
BB002837
Product Name:
6-Heptenoic acid
CAS:
1119-60-4
Synonyms:
hept-6-enoic acid
Ordering Information
Catalog
Size
Price
Stock
Quantity
BB002837
25 g
$629
In stock
0
1
2
3
4
5
6
7
8
9
IUPAC Name: hept-6-enoic acid
Description: 6-Heptenoic acid (CAS# 1119-60-4) is a useful research chemical compound.
Molecular Weight: 128.17
Molecular Formula: C7H12O2
Canonical SMILES: C=CCCCCC(=O)O
InChI: InChI=1S/C7H12O2/c1-2-3-4-5-6-7(8)9/h2H,1,3-6H2,(H,8,9)
InChI Key: RWNJOXUVHRXHSD-UHFFFAOYSA-N
Boiling Point: 226 °C at 760 mmHg
Melting Point: -6.5 °C (lit.)
Purity: 95 %
Density: 0.946 g/mL at 25 °C (lit.)
Storage: 2-8 °C
MDL: MFCD00014382
LogP: 1.81740
GHS Hazard Statement: H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]
Precautionary Statement: P260, P264, P280, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P363, P405, and P501
Signal Word: Danger
Publication Number Title Priority Date
WO-2021094830-A2 Nitrogen oxide-donating pde-5 and/or pde-6 inhibitor compounds 20191111
US-2021047563-A1 SYNTHESIS OF BLUE-EMITTING ZnSe1-xTex ALLOY NANOCRYSTALS WITH LOW FULL WIDTH AT HALF-MAXIMUM 20190812
WO-2021030432-A1 SYNTHESIS OF BLUE-EMITTING ZnSe1-xTex ALLOY NANOCRYSTALS WITH LOW FULL WIDTH AT HALF-MAXIMUM 20190812
US-2020392405-A1 Etching compositions 20190613
WO-2020251800-A1 Etching compositions 20190613
PMID Publication Date Title Journal
21588039 20100626 (E)-7-(Pyren-1-yl)hept-6-enoic acid Acta crystallographica. Section E, Structure reports online
16190750 20051006 Design, synthesis, and biological activity of m-tyrosine-based 16- and 17-membered macrocyclic inhibitors of hepatitis C virus NS3 serine protease Journal of medicinal chemistry
Complexity: 97.1
Compound Is Canonicalized: Yes
Covalently-Bonded Unit Count: 1
Defined Atom Stereocenter Count: 0
Defined Bond Stereocenter Count: 0
Exact Mass: 128.083729621
Formal Charge: 0
Heavy Atom Count: 9
Hydrogen Bond Acceptor Count: 2
Hydrogen Bond Donor Count: 1
Isotope Atom Count: 0
Monoisotopic Mass: 128.083729621
Rotatable Bond Count: 5
Topological Polar Surface Area: 37.3 Å2
Undefined Atom Stereocenter Count: 0
Undefined Bond Stereocenter Count: 0
XLogP3: 1.7
Online Inquiry
Customer Support
Customer Centered
Related Functional Groups
Alkenes
Customers Also Viewed
INDUSTRY LEADERS TRUST OUR PRODUCTS