4-(Dimethylamino)butyraldehyde Diethyl Acetal - CAS 1116-77-4
Catalog: |
BB002787 |
Product Name: |
4-(Dimethylamino)butyraldehyde Diethyl Acetal |
CAS: |
1116-77-4 |
Synonyms: |
4,4-diethoxy-N,N-dimethyl-1-butanamine; 4,4-diethoxy-N,N-dimethylbutan-1-amine |
IUPAC Name: | 4,4-diethoxy-N,N-dimethylbutan-1-amine |
Description: | 4-(Dimethylamino)butyraldehyde Diethyl Acetal (CAS# 1116-77-4) is used in the preparation of N,N-Dimethyltryptamines, 5-HT1D receptor agonists, for medicinal treatments such as antimigraine drugs. |
Molecular Weight: | 189.30 |
Molecular Formula: | C10H23NO2 |
Canonical SMILES: | CCOC(CCCN(C)C)OCC |
InChI: | InChI=1S/C10H23NO2/c1-5-12-10(13-6-2)8-7-9-11(3)4/h10H,5-9H2,1-4H3 |
InChI Key: | QKXMWBLNSPNBEY-UHFFFAOYSA-N |
Boiling Point: | 230.7 °C at 760 mmHg |
Density: | 0.884 g/cm3 |
MDL: | MFCD00671479 |
LogP: | 1.72730 |
GHS Hazard Statement: | H315 (14.29%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P310, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
CN-113121512-A | Preparation method of quinazolinyl butene amide compound | 20191230 |
EP-3650447-A1 | New selective modulators of insect nicotinic acetylcholine receptors | 20181108 |
CN-107488152-B | Afatinib intermediate and synthetic method thereof | 20160610 |
CN-105498280-A | Hydrophilic reversible solvent assisted oil-sand separation method | 20151225 |
EP-3383854-A1 | Water-soluble uv-absorbing compounds and uses thereof | 20151202 |
Complexity: | 101 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 189.172878976 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 189.172878976 |
Rotatable Bond Count: | 8 |
Topological Polar Surface Area: | 21.7 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.6 |
Online Inquiry
Customer Support
Customer Centered
Related Functional Groups
Carbonyl Compounds
Customers Also Viewed
-
[35045-02-4]
Metribuzin-desamino
-
[1427004-19-0]
DBCO-PEG4-NHS ester
-
[3821-81-6]
3-Amino-2-fluoropropionic acid
-
[875573-66-3]
Estra-1,3,5(10)-triene-3,17-diol,7-(9-bromononyl)-,17-acetate,(7a,17b)-
-
[110782-31-5]
N-Benzoyl-5'-O-(4,4'-dimethoxytrityl)-2'-O-methyladenosine-3'-(2-cyanoethyl-N,N-diisopropyl)phosphoramidite
-
[169689-05-8]
1S,2S-DHAC-Phenyl Trost Ligand
INDUSTRY LEADERS TRUST OUR PRODUCTS