2-Dimethylaminomethylenecyclohexane-1,3-dione - CAS 85302-07-4
Catalog: |
BB037585 |
Product Name: |
2-Dimethylaminomethylenecyclohexane-1,3-dione |
CAS: |
85302-07-4 |
Synonyms: |
2-(dimethylaminomethylidene)cyclohexane-1,3-dione |
IUPAC Name: | 2-(dimethylaminomethylidene)cyclohexane-1,3-dione |
Description: | 2-Dimethylaminomethylenecyclohexane-1,3-dione (CAS# 85302-07-4) is a useful research chemical. |
Molecular Weight: | 167.21 |
Molecular Formula: | C9H13NO2 |
Canonical SMILES: | CN(C)C=C1C(=O)CCCC1=O |
InChI: | InChI=1S/C9H13NO2/c1-10(2)6-7-8(11)4-3-5-9(7)12/h6H,3-5H2,1-2H3 |
InChI Key: | USUMAAZJCOVPIN-UHFFFAOYSA-N |
Boiling Point: | 274.5 °C at 760 mmHg |
Purity: | 97 % |
Density: | 1.19 g/cm3 |
Appearance: | Yellow powder |
MDL: | MFCD00172118 |
LogP: | 0.75400 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
WO-2021090030-A1 | Gpr52 modulator compounds | 20191108 |
WO-2021038452-A1 | New therapeutic agents for the treatment of haematological pathologies | 20190826 |
WO-2021031984-A1 | Carboxylic acid oxime ester compound and use thereof | 20190816 |
CN-112390725-A | Preparation method of amide compound | 20190816 |
CN-112390727-A | Oxime carboxylate compound and application thereof | 20190816 |
Complexity: | 223 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 167.094628657 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 167.094628657 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 37.4 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.4 |
Online Inquiry
Customer Support
Customer Centered
Related Functional Groups
Nitrogen Compounds
-
[89908-23-6]C23H22N2O5
2-Propenoic acid, 2-(3',3'-dimethyl-6-nitrospiro[2H-1-benzopyran-2,2'-[2H]indol]-1'(3'H)-yl)ethyl ester
-
[1383427-98-2]C7H13ClN2O2
(S)-Hexahydropyrazino[2,1-c][1,4]oxazin-4(3H)-one hydrochloride
-
[51355-91-0]C6H8ClN3O2
1-(Chloromethyl)-3,5-dimethyl-4-nitro-1H-pyrazole
-
[102388-00-1]C4H4ClN3O2
1-(Chloromethyl)-3-nitro-1H-pyrazole
-
[1170836-25-5]C8H11N3O2
1-Cyclopentyl-5-nitro-1H-pyrazole
-
[865774-78-3]C16H21F2NO2
2-(6,8-difluoro-1,2,3,4-tetrahydro-naphthalen-2-ylamino)-pentanoic acid methyl ester
Customers Also Viewed
INDUSTRY LEADERS TRUST OUR PRODUCTS