CAS
93778-06-4 Purity
96%
93778-06-4 Purity
96%
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4-[(2-Aminophenyl)methyl]-2-isopropylaniline
CAS
93778-10-0
Catalog Number
ACM93778100
Category
Other Products
Molecular Weight
240.343400 [g/mol]
Molecular Formula
C16H20N2
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Specification
Synonyms
EINECS 298-143-9, CID3022323, 4-((2-Aminophenyl)methyl)-2-isopropylaniline, 93778-10-0
IUPAC Name
4-[(2-aminophenyl)methyl]-2-propan-2-ylaniline
InChI Key
QGUUNOJHENWOKQ-UHFFFAOYSA-N
Boiling Point
409.9ºC at 760 mmHg
Flash Point
241.4ºC
Density
1.075g/cm³
Exact Mass
240.16300
H-Bond Acceptor
2
H-Bond Donor
2
What is the molecular formula of the compound?
The molecular formula is C16H20N2.
What is the molecular weight of the compound?
The molecular weight is 240.34 g/mol.
What is the IUPAC name of the compound?
The IUPAC name is 4-[(2-aminophenyl)methyl]-2-propan-2-ylaniline.
What is the InChI key of the compound?
The InChI key is QGUUNOJHENWOKQ-UHFFFAOYSA-N.
How many hydrogen bond donor counts does the compound have?
The compound has 2 hydrogen bond donor counts.
What is the XLogP3-AA value of the compound?
The XLogP3-AA value is 3.6.
What is the topological polar surface area of the compound?
The topological polar surface area is 52 Å^2.
How many rotatable bond counts does the compound have?
The compound has 3 rotatable bond counts.
Is the compound canonicalized?
Yes, the compound is canonicalized.
What is the formal charge of the compound?
The formal charge of the compound is 0.
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