6-(Dimethylamino)fulvene - CAS 696-68-4
Catalog: |
BB033920 |
Product Name: |
6-(Dimethylamino)fulvene |
CAS: |
696-68-4 |
Synonyms: |
1-cyclopenta-2,4-dien-1-ylidene-N,N-dimethylmethanamine |
IUPAC Name: | 1-cyclopenta-2,4-dien-1-ylidene-N,N-dimethylmethanamine |
Description: | 6-(Dimethylamino)fulvene (CAS# 696-68-4) is a useful research chemical. |
Molecular Weight: | 121.18 |
Molecular Formula: | C8H11N |
Canonical SMILES: | CN(C)C=C1C=CC=C1 |
InChI: | InChI=1S/C8H11N/c1-9(2)7-8-5-3-4-6-8/h3-7H,1-2H3 |
InChI Key: | UJXXVGXQTXQALL-UHFFFAOYSA-N |
Boiling Point: | 205.3 °C at 760 mmHg |
Density: | 1.042 g/cm3 |
Appearance: | Brown powder |
MDL: | MFCD00013275 |
LogP: | 1.55790 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
WO-2020024099-A1 | Cyclopentadienyl [c] chromium compound and preparation method therefor | 20180730 |
WO-2020024100-A1 | Method for preparing cyclopentadienyl [c] chromium compound | 20180730 |
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JP-2018178009-A | Adhesive composition for semiconductor device and adhesive tape for semiconductor device | 20170417 |
PMID | Publication Date | Title | Journal |
22223540 | 20120206 | Reaction of a 6-dimethylaminopentafulvene with the Mes2PCH2CH2B(C6F5)2 frustrated Lewis pair | Chemistry (Weinheim an der Bergstrasse, Germany) |
17412456 | 20080101 | Synthesis and cytotoxicity studies of new dimethylamino-functionalised and aryl-substituted titanocene anti-cancer agents | European journal of medicinal chemistry |
18274663 | 20080101 | Synthesis and cytotoxicity studies of titanocene C analogues | Metal-based drugs |
17516024 | 20071001 | Dimethylamino-functionalised and N-heteroaryl-substituted titanocene anticancer drugs: synthesis and cytotoxicity studies | Investigational new drugs |
12003546 | 20020517 | Asymmetric synthesis of metallocenes through enantioselective addition of organolithium reagents to 6-(dimethylamino)fulvene | The Journal of organic chemistry |
Complexity: | 159 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 121.089149355 |
Formal Charge: | 0 |
Heavy Atom Count: | 9 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 121.089149355 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 3.2 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.8 |
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