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346268

6-Nitrohexanoic acid

Name: 6-Nitrohexanoic acid
Brand: ALDRICH

98%

Synonym(s):

6-Nitrocaproic acid

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About This Item

Linear Formula:

O₂N(CH₂)₅CO₂H

CAS Number:

10269-96-2

Molecular Weight:

161.16

NACRES:

NA.22

PubChem Substance ID:

24861386

UNSPSC Code:

12352100

MDL number:

MFCD00075346

Assay:

98%

Form:

solid

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Properties

assay

98%

form

solid

refractive index

n20/D 1.459 (lit.)

bp

136 °C/0.3 mmHg (lit.)

mp

21-22 °C (lit.)

density

1.186 g/mL at 25 °C (lit.)

functional group

amine, carboxylic acid, nitro

SMILES string

OC(=O)CCCCC[N+]([O-])=O

InChI

1S/C6H11NO4/c8-6(9)4-2-1-3-5-7(10)11/h1-5H2,(H,8,9)

InChI key

RDMHCTBEKVBKLF-UHFFFAOYSA-N

Description

Application

6-Nitrohexanoic acid may be used in the synthesis of 6-aminohexanoic acid, which on polymerization yields Nylon-6. It may be used in the synthesis of conjugable analog of benzodiazepine 4′′chlorodiazepam (Ro5-4864), C₆Ro5-4864.

pictograms

GHS07

signalword

Warning

hcodes

H302,H315,H319,H335

pcodes

P261 - P264 - P270 - P301 + P312 - P302 + P352 - P305 + P351 + P338

Hazard Classifications

Acute Tox. 4 Oral - Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3

target_organs

Respiratory system

Storage Class

11 - Combustible Solids

wgk

WGK 3

flash_point_f

235.4 °F - closed cup

flash_point_c

113 °C - closed cup

ppe

dust mask type N95 (US), Eyeshields, Gloves

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