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C₁₇H₂₀N₂O₃CAS 120-00-3300.36 g/mol

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Ether Primary amine

Properties

Molecular formula: C₁₇H₂₀N₂O₃
Molar mass: 300.36 g/mol
Exact mass: 300.1474 Da
Melting point: 101 °C
logP: 3.70Crippen estimate
Polar surface area: 77.1 Å²
H-bond donors / acceptors: 2 / 4
Rotatable bonds: 6

Hazards

Danger

H315 Causes skin irritation100% of notifiers
H318 Causes serious eye damage92.7% of notifiers
H335 May cause respiratory irritation95.1% of notifiers

Aggregated from 41 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P332+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

120-00-3

SMILES

CCOc1cc(N=C(O)c2ccccc2)c(OCC)cc1N

InChIKey

CNXZLZNEIYFZGU-UHFFFAOYSA-N

InChI

InChI=1S/C17H20N2O3/c1-3-21-15-11-14(16(22-4-2)10-13(15)18)19-17(20)12-8-6-5-7-9-12/h5-11H,3-4,18H2,1-2H3,(H,19,20)

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Names and synonyms

13 names · show all

Benzamide, N-(4-amino-2,5-diethoxyphenyl)-
Benzanilide, 4′-amino-2′,5′-diethoxy-
N-(4-Amino-2,5-diethoxyphenyl)benzamide
Blue salt NBB
Brentamine fast blue 2B base
Brentamine fast blue BB base
Fast blue EB base
Spectrolene blue BB
4-Amino-1-(benzoylamino)-3,6-diethoxybenzene
1-Amino-4-(benzoylamino)-2,5-diethoxybenzene
2,5-Diethoxy-4-benzamidoaniline
4-Benzamido-2,5-diethoxyaniline
NSC 37184

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Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

4-Benzoylamino-2,5-dimethoxyaniline6268-05-968 % similar 2′,5′-Diethoxybenzanilide92-22-865 % similar N-(4-Amino-5-methoxy-2-methylphenyl)benzamide99-21-857 % similar 3-Amino-4-methoxy-N-phenylbenzamide120-35-445 % similar 2-Ethoxyaniline94-70-244 % similar 3,4-Diethoxybenzohydrazide380482-31-544 % similar N-(2-Ethoxyphenyl)-3-hydroxy-2-naphthalenecarboxamide92-74-044 % similar 2,5-Diethoxyaniline94-85-941 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

Bifenazate149877-41-8

Elsewhere

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