4-(Dimethylaminomethyl)aniline - CAS 6406-74-2
Catalog: |
BB032363 |
Product Name: |
4-(Dimethylaminomethyl)aniline |
CAS: |
6406-74-2 |
Synonyms: |
4-[(dimethylamino)methyl]aniline; 4-[(dimethylamino)methyl]aniline |
IUPAC Name: | 4-[(dimethylamino)methyl]aniline |
Description: | 4-(Dimethylaminomethyl)aniline (CAS# 6406-74-2) is a reagent in the reaction with methoxycarbonylphenyl isocyanate, in the synthesis of 4H-3,1-benzoxazin-4-ones as potent alternate substrate inhibitors of human leukocyte elastase. |
Molecular Weight: | 150.22 |
Molecular Formula: | C9H14N2 |
Canonical SMILES: | CN(C)CC1=CC=C(C=C1)N |
InChI: | InChI=1S/C9H14N2/c1-11(2)7-8-3-5-9(10)6-4-8/h3-6H,7,10H2,1-2H3 |
InChI Key: | NNCCQALFJIMRKB-UHFFFAOYSA-N |
Boiling Point: | 260 ℃ at 760 mmHg |
Density: | 1.019 g/cm3 |
MDL: | MFCD00035953 |
LogP: | 1.91160 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P310, P312, P321, P322, P330, P332+P313, P362, P363, P403+P233, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
US-2021174983-A1 | Compositions for the filling of high aspect ratio vertical interconnect access (via) holes | 20191204 |
WO-2021112933-A1 | Compositions for the filling of high aspect ratio vertical interconnect access (via) holes | 20191204 |
KR-20210064093-A | Novel triazolopyridine derivatives and pharmaceutical composition comprising the same | 20191125 |
WO-2021107590-A1 | Novel triazolopyridine derivative and pharmaceutical composition comprising same | 20191125 |
WO-2020156357-A1 | Compound having benzo seven-membered ring structure, preparation method therefor, and use thereof | 20190202 |
Complexity: | 104 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 150.115698455 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 150.115698455 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 29.3 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.5 |
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Related Functional Groups
Amines and Anilines
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