3-Methyl-N-methylbenzylamine - CAS 39180-84-2
Catalog: |
BB023868 |
Product Name: |
3-Methyl-N-methylbenzylamine |
CAS: |
39180-84-2 |
Synonyms: |
N-methyl-1-(3-methylphenyl)methanamine |
IUPAC Name: | N-methyl-1-(3-methylphenyl)methanamine |
Description: | 3-Methyl-N-methylbenzylamine (CAS# 39180-84-2) is a useful research chemical. |
Molecular Weight: | 135.21 |
Molecular Formula: | C9H13N |
Canonical SMILES: | CC1=CC(=CC=C1)CNC |
InChI: | InChI=1S/C9H13N/c1-8-4-3-5-9(6-8)7-10-2/h3-6,10H,7H2,1-2H3 |
InChI Key: | WCTNVGNEUDTSOZ-UHFFFAOYSA-N |
Boiling Point: | 90-92 °C (15 mmHg) |
Purity: | 95 % |
Density: | 0.900 g/cm3 |
Solubility: | Slightly soluble in water. |
Appearance: | Solid |
MDL: | MFCD05865181 |
LogP: | 2.10530 |
GHS Hazard Statement: | H318 (100%): Causes serious eye damage [Danger Serious eye damage/eye irritation] |
Precautionary Statement: | P280, P305+P351+P338, and P310 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
WO-2021160696-A1 | In-vitro diagnosis of histamine intolerance syndrome | 20200210 |
WO-2021072203-A1 | Tgfbetar1 inhibitor-asgr antibody conjugates and uses thereof | 20191009 |
WO-2021011834-A1 | Alk5 inhibitors, conjugates, and uses thereof | 20190716 |
WO-2020093905-A1 | Ring-fused compound, preparation method therefor and application thereof | 20181107 |
CN-112654622-A | Fused ring compound, preparation method and application thereof | 20181107 |
Complexity: | 90.7 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 135.104799419 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 135.104799419 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 12 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.9 |
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