CAS
91545-93-6 Purity
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91545-93-6 Purity
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Benzeneethanamine,4-(1,1-dimethylethyl)-
CAS
91552-82-8
Catalog Number
ACM91552828
Category
Other Products
Molecular Weight
177.29
Molecular Formula
C12H19N
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Specification
Synonyms
RARECHEM AL BW 0742;2-(4-TERT-BUTYLPHENYL)ETHYALMINE;2-(4-TERT-BUTYLPHENYL)ETHYLAMINE;4-(TERT-BUTYL)PHENETHYLAMINE;Butylphenylethylamine;2-(4-tert-Butylphenyl)ethylamine 97%
IUPAC Name
2-(4-tert-butylphenyl)ethanamine
Canonical SMILES
CC(C)(C)C1=CC=C(C=C1)CCN
InChI Key
WKCZSFRAGKIIKN-UHFFFAOYSA-N
Boiling Point
80ºC(1 torr)
Flash Point
115.7ºC
Density
0.92g/cm³
Exact Mass
177.15200
Hazard Statements
Xi: Irritant;
H-Bond Acceptor
1
H-Bond Donor
1
Safety Description
26-36/37/39
What is the molecular formula of Benzeneethanamine, 4-(1,1-dimethylethyl)?
The molecular formula of Benzeneethanamine, 4-(1,1-dimethylethyl) is C12H19N.
What is the molecular weight of Benzeneethanamine, 4-(1,1-dimethylethyl)?
The molecular weight of Benzeneethanamine, 4-(1,1-dimethylethyl) is 177.29 g/mol.
What is the IUPAC name of Benzeneethanamine, 4-(1,1-dimethylethyl)?
The IUPAC name of Benzeneethanamine, 4-(1,1-dimethylethyl) is 2-(4-tert-butylphenyl)ethanamine.
What is the InChI of Benzeneethanamine, 4-(1,1-dimethylethyl)?
The InChI of Benzeneethanamine, 4-(1,1-dimethylethyl) is InChI=1S/C12H19N/c1-12(2,3)11-6-4-10(5-7-11)8-9-13/h4-7H,8-9,13H2,1-3H3.
What is the InChIKey of Benzeneethanamine, 4-(1,1-dimethylethyl)?
The InChIKey of Benzeneethanamine, 4-(1,1-dimethylethyl) is WKCZSFRAGKIIKN-UHFFFAOYSA-N.
What is the canonical SMILES of Benzeneethanamine, 4-(1,1-dimethylethyl)?
The canonical SMILES of Benzeneethanamine, 4-(1,1-dimethylethyl) is CC(C)(C)C1=CC=C(C=C1)CCN.
What is the CAS number of Benzeneethanamine, 4-(1,1-dimethylethyl)?
The CAS number of Benzeneethanamine, 4-(1,1-dimethylethyl) is 91552-82-8.
What is the exact mass of Benzeneethanamine, 4-(1,1-dimethylethyl)?
The exact mass of Benzeneethanamine, 4-(1,1-dimethylethyl) is 177.151749610 g/mol.
How many hydrogen bond donor counts does Benzeneethanamine, 4-(1,1-dimethylethyl) have?
Benzeneethanamine, 4-(1,1-dimethylethyl) has 1 hydrogen bond donor count.
Is Benzeneethanamine, 4-(1,1-dimethylethyl) a canonicalized compound?
Yes, Benzeneethanamine, 4-(1,1-dimethylethyl) is a canonicalized compound.
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