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Structure

Benzenemethanamine,2,4-dichloro-a-methyl-

CAS
89981-75-9
Catalog Number
ACM89981759
Category
Other Products
Molecular Weight
190.07
Molecular Formula
C8H9Cl2N

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Specification

Synonyms
ZINC03378499, ZINC03378501, CID2496564, 89981-75-9
IUPAC Name
[(1R)-1-(2,4-dichlorophenyl)ethyl]azanium
Canonical SMILES
CC(C1=C(C=C(C=C1)Cl)Cl)N
InChI Key
OUVZHZAOWDHBOU-RXMQYKEDSA-O
Boiling Point
132ºC / 15mmHg
Flash Point
108.8ºC
Density
1.262 g/cm³
Exact Mass
189.01100
Hazard Statements
C: Corrosive;Xi: Irritant;
H-Bond Acceptor
0
H-Bond Donor
1
Safety Description
36/37/39
What is the molecular formula of Benzenemethanamine, 2,4-dichloro-a-methyl?

Molecular Formula: C8H9Cl2N

When was Benzenemethanamine, 2,4-dichloro-a-methyl created and modified?

Create Date: 2005-07-19
Modify Date: 2023-12-30

What is the IUPAC Name of Benzenemethanamine, 2,4-dichloro-a-methyl?

IUPAC Name: 1-(2,4-dichlorophenyl)ethanamine

What is the InChIKey of Benzenemethanamine, 2,4-dichloro-a-methyl?

InChIKey: OUVZHZAOWDHBOU-UHFFFAOYSA-N

What is the Canonical SMILES of Benzenemethanamine, 2,4-dichloro-a-methyl?

Canonical SMILES: CC(C1=C(C=C(C=C1)Cl)Cl)N

What is the CAS number for Benzenemethanamine, 2,4-dichloro-a-methyl?

CAS Number: 89981-75-9

What is the molecular weight of Benzenemethanamine, 2,4-dichloro-a-methyl?

Molecular Weight: 190.07 g/mol

How many hydrogen bond donor counts does Benzenemethanamine, 2,4-dichloro-a-methyl have?

Hydrogen Bond Donor Count: 1

What is the topological polar surface area of Benzenemethanamine, 2,4-dichloro-a-methyl?

Topological Polar Surface Area: 26㎡

Is the compound considered canonicalized?

Compound Is Canonicalized: Yes

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