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Structure

Aniline HydroBromide

CAS
542-11-0
Catalog Number
ACM542110-1
Category
Other Products
Molecular Weight
174.04 g/mol
Molecular Formula
C6H7N•HBr

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Specification

Synonyms
Anilinium Bromide
IUPAC Name
aniline;hydrobromide
Canonical SMILES
C1=CC=C(C=C1)N.Br
InChI
InChI=1S/C6H7N.BrH/c7-6-4-2-1-3-5-6;/h1-5H,7H2;1H
InChI Key
KBPWECBBZZNAIE-UHFFFAOYSA-N
Melting Point
285 °C(dec.)
Appearance
White to Light yellow to Dark green powder to crystal
Storage
Store under inert gas
Color
White to Light yellow to Dark green Powder to crystal
Complexity
46.1
Condition To Avoid
Hygroscopic
Covalently-Bonded Unit Count
2
EC Number
208-801-9
Exact Mass
172.98401g/mol
Form
Solid
Formal Charge
0
Hazard Statements
H315 : Causes skin irritation.H319 : Causes serious eye irritation.
H-Bond Acceptor
1
H-Bond Donor
2
Heavy Atom Count
8
MDL Number
MFCD00035465
Monoisotopic Mass
172.98401g/mol
Precautionary Statements
P264 : Wash skin thoroughly after handling.P280 : Wear protective gloves/ eye protection/ face protection.P337 + P313 : If eye irritation persists: Get medical advice/ attention.P305 + P351 + P338 : IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing.P302 + P352 : IF ON SKIN: Wash with plenty of soap and water.P332 + P313 : If skin irritation occurs: Get medical advice/ attention.P362 : Take off contaminated clothing and wash before reuse.
Rotatable Bond Count
0
Signal Word
Warning
UNII
01XK3D1SXO
What is the molecular formula of aniline hydrobromide?

The molecular formula of aniline hydrobromide is C6H8BrN.

What is the molecular weight of aniline hydrobromide?

The molecular weight of aniline hydrobromide is 174.04 g/mol.

What is the parent compound of aniline hydrobromide?

The parent compound of aniline hydrobromide is aniline, which has the CID 6115.

What are the synonyms for aniline hydrobromide?

The synonyms for aniline hydrobromide include anilinium bromide, phenylammonium bromide, and benzenamine hydrobromide.

When was aniline hydrobromide created?

Aniline hydrobromide was created on March 27, 2005.

What is the IUPAC name of aniline hydrobromide?

The IUPAC name of aniline hydrobromide is aniline; hydrobromide.

What is the InChI of aniline hydrobromide?

The InChI of aniline hydrobromide is InChI=1S/C6H7N.BrH/c7-6-4-2-1-3-5-6;/h1-5H,7H2;1H.

What is the InChIKey of aniline hydrobromide?

The InChIKey of aniline hydrobromide is KBPWECBBZZNAIE-UHFFFAOYSA-N.

What is the canonical SMILES of aniline hydrobromide?

The canonical SMILES of aniline hydrobromide is C1=CC=C(C=C1)N.Br.

What is the CAS number of aniline hydrobromide?

The CAS number of aniline hydrobromide is 542-11-0.

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