2,2'-[4-(2-Hydroxyethylamino)-3-nitrophenylimino]diethanol - CAS 33229-34-4
Catalog: |
BB021619 |
Product Name: |
2,2'-[4-(2-Hydroxyethylamino)-3-nitrophenylimino]diethanol |
CAS: |
33229-34-4 |
Synonyms: |
2-[4-[bis(2-hydroxyethyl)amino]-2-nitroanilino]ethanol |
IUPAC Name: | 2-[4-[bis(2-hydroxyethyl)amino]-2-nitroanilino]ethanol |
Description: | 2,2'-[4-(2-Hydroxyethylamino)-3-nitrophenylimino]diethanol (CAS# 33229-34-4) is a hair dye compound containing hexyl glyceryl ether and/or hexanediol. |
Molecular Weight: | 285.30 |
Molecular Formula: | C12H19N3O5 |
Canonical SMILES: | C1=CC(=C(C=C1N(CCO)CCO)[N+](=O)[O-])NCCO |
InChI: | InChI=1S/C12H19N3O5/c16-6-3-13-11-2-1-10(9-12(11)15(19)20)14(4-7-17)5-8-18/h1-2,9,13,16-18H,3-8H2 |
InChI Key: | MIWUTEVJIISHCP-UHFFFAOYSA-N |
Boiling Point: | 582.7 ℃ at 760 mmHg |
Melting Point: | 108-111 ℃ |
Purity: | ≥ 98 % |
Density: | 1.421 g/cm3 |
Solubility: | less than 1 mg/mL at 75 °F |
Appearance: | Dark blue to dark brown microcrystalline powder. |
Storage: | Keep in a cool, dry, dark location in a tightly sealed container or cylinder. Keep away from incompatible materials, ignition sources and untrained individuals. Secure and label area. Protect containers/cylinders from physical damage. |
LogP: | 0.38620 |
GHS Hazard Statement: | H315 (60.91%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P272, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P333+P313, P337+P313, P362, P363, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
WO-2021211393-A1 | Hair color modification additive and related methods | 20200412 |
DE-102020204541-A1 | A method of coloring keratinic material, comprising the use of an organosilicon compound, a polysaccharide, a coloring compound and an aftertreatment agent | 20200408 |
WO-2021204441-A1 | Method for dyeing keratin material, comprising the use of a organosilicon compound, a polysaccharide, a coloring compound and a post-treatment agent | 20200408 |
DE-102020203743-A1 | Improvement of the wash fastness of pigment-containing dyes by using an oxidative pretreatment agent | 20200324 |
JP-2021151971-A | Hair cosmetic composition | 20200324 |
Complexity: | 281 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 285.13247072 |
Formal Charge: | 0 |
Heavy Atom Count: | 20 |
Hydrogen Bond Acceptor Count: | 7 |
Hydrogen Bond Donor Count: | 4 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 285.13247072 |
Rotatable Bond Count: | 8 |
Topological Polar Surface Area: | 122 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.4 |
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