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5-Nitro-2-propoxyaniline

5-Nitro-2-propoxyaniline structure

CAS No:
553-79-7
Formula:
C9H12N2O3
Chemical Name:
5-Nitro-2-propoxyaniline
Synonyms:
Benzenamine,5-nitro-2-propoxy-;Aniline,5-nitro-2-propoxy-;5-Nitro-2-propoxybenzenamine;2-Amino-4-nitro-1-n-propoxybenzene;1-Propoxy-2-amino-4-nitrobenzene;Ultrasuss;Ultrasweet;P 4000 (sweetener);5-Nitro-2-propoxyaniline;Aros X;Ultrasuess;Sweetening agent P 4000;P 4000;2-Propoxy-5-nitroaniline;NSC 108776;5-Nitro-2-propoxyphenylamine;2-Amino-4-nitro-1-propoxybenzene
Categories:
Organic Chemistry > Amides

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Description

Artificial sweetener.

Solid

5-Nitro-2-propoxyaniline Basic Attributes

Molecular Weight：

196.20300

Exact Mass：

196.20

EC Number：

209-049-4

UNII：

HDS42MR6BM

NSC Number：

108776

DSSTox ID：

DTXSID50203827

HScode：

2922299090

Characteristics

PSA：

81.07000

XLogP3：

3.07020

Appearance：

Solid

Density：

1.221g/cm3

Melting Point：

49 °C

Boiling Point：

367ºC at 760mmHg

Flash Point：

175.8ºC

Refractive Index：

1.573

Water Solubility：

0.136 mg/mL at 20 °C

Safety Information

wgk germany：

Drug Information

MeSH Entry Terms：

1-N-propoxy-2-amino-4- nitrobenzene

5-Nitro-2-propoxyaniline Use and Manufacturing

Food additive (prohibited).

Computed Properties

Molecular Weight:196.20
XLogP3:2.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:196.08479225
Monoisotopic Mass:196.08479225
Topological Polar Surface Area:81.1
Heavy Atom Count:14
Complexity:193
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes