Structure

Bis(4-bromophenyl)amine

CAS
16292-17-4
Catalog Number
ACM16292174
Category
Amines
Molecular Weight
327.01
Molecular Formula
C12H9Br2N

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Specification

Synonyms
4,4'-Di(bromophenyl)amine
IUPAC Name
4-bromo-N-(4-bromophenyl)aniline
Canonical SMILES
C1=CC(=CC=C1NC2=CC=C(C=C2)Br)Br
InChI
InChI=1S/C12H9Br2N/c13-9-1-5-11(6-2-9)15-12-7-3-10(14)4-8-12/h1-8,15H
InChI Key
VKVHTZNHLOGHGP-UHFFFAOYSA-N
Boiling Point
380.5±27.0 ºC
Melting Point
106 ºC
Density
1.740±0.06 g/ml
Appearance
White to Almost white powder to crystal
Storage
Keep in dark place. Inert atmosphere. Room temperature.
Complexity
162
Covalently-Bonded Unit Count
1
Exact Mass
326.90813g/mol
Formal Charge
0
Hazard Statements
H315 : Causes skin irritation.H319 : Causes serious eye irritation.
H-Bond Acceptor
1
H-Bond Donor
1
Heavy Atom Count
15
Monoisotopic Mass
324.91017g/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.
RIDADR
NONH for all modes of transport
Rotatable Bond Count
2
Signal Word
Warning
Symbol
GHS05
XLogP3
4.8
What is the molecular formula of Bis(4-bromophenyl)amine?

The molecular formula of Bis(4-bromophenyl)amine is C12H9Br2N.

When was Bis(4-bromophenyl)amine first created and last modified?

Bis(4-bromophenyl)amine was first created on March 28, 2005, and last modified on November 25, 2023.

What is the IUPAC name of Bis(4-bromophenyl)amine?

The IUPAC name of Bis(4-bromophenyl)amine is 4-bromo-N-(4-bromophenyl)aniline.

What is the InChIKey of Bis(4-bromophenyl)amine?

The InChIKey of Bis(4-bromophenyl)amine is VKVHTZNHLOGHGP-UHFFFAOYSA-N.

How many hydrogen bond donor counts does Bis(4-bromophenyl)amine have?

Bis(4-bromophenyl)amine has 1 hydrogen bond donor count.

What is the exact mass of Bis(4-bromophenyl)amine?

The exact mass of Bis(4-bromophenyl)amine is 326.90813 g/mol.

What is the topological polar surface area of Bis(4-bromophenyl)amine?

The topological polar surface area of Bis(4-bromophenyl)amine is 12Ų.

How many heavy atoms does Bis(4-bromophenyl)amine contain?

Bis(4-bromophenyl)amine contains 15 heavy atoms.

Is the compound Bis(4-bromophenyl)amine canonicalized?

Yes, Bis(4-bromophenyl)amine is canonicalized.

What is the molecular weight of Bis(4-bromophenyl)amine?

The molecular weight of Bis(4-bromophenyl)amine is 327.01 g/mol.

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