2-Ethyl-6-(1-methylpropyl)benzenamine - CAS 71758-10-6
Catalog: |
BB066095 |
Product Name: |
2-Ethyl-6-(1-methylpropyl)benzenamine |
CAS: |
71758-10-6 |
Synonyms: |
2-Ethyl-6-sec-butylaniline; 2-sec-Butyl-6-ethylaniline; 2-butan-2-yl-6-ethylaniline; 2-(sec-Butyl)-6-ethylaniline; Benzenamine, 2-ethyl-6-(1-methylpropyl)-; 6-sec-Butyl-2-ethylaniline |
IUPAC Name: | 2-butan-2-yl-6-ethylaniline |
Molecular Weight: | 177.29 |
Molecular Formula: | C12H19N |
Canonical SMILES: | CCC1=C(C(=CC=C1)C(C)CC)N |
InChI: | InChI=1S/C12H19N/c1-4-9(3)11-8-6-7-10(5-2)12(11)13/h6-9H,4-5,13H2,1-3H3 |
InChI Key: | ZZWRNKKMYDEAIK-UHFFFAOYSA-N |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Warning |
Complexity: | 144 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 177.15174961 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 177.15174961 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 26Ų |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.7 |
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