CAS
96274-83-8 Purity
96%
96274-83-8 Purity
96%
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2-[1-(Methylamino)ethyl]indole
CAS
96286-08-7
Catalog Number
ACM96286087
Category
Other Products
Molecular Weight
174.24
Molecular Formula
C11H14N2
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Specification
Synonyms
N,α-Dimethyl-
IUPAC Name
1-(1H-indol-2-yl)-N-methylethanamine
Canonical SMILES
CC(C1=CC2=CC=CC=C2N1)NC
InChI Key
KLFJXADECANLNB-UHFFFAOYSA-N
Boiling Point
310.1ºC at 760 mmHg
Melting Point
95-95.5ºC
Flash Point
141.3ºC
Density
1.083g/cm³
Appearance
Yellow Crystalline Solid
Exact Mass
174.11600
H-Bond Acceptor
1
H-Bond Donor
2
What is the molecular formula of the compound?
The molecular formula of the compound is C11H14N2.
What is the molecular weight of the compound?
The molecular weight of the compound is 174.24 g/mol.
What is the IUPAC name of the compound?
The IUPAC name of the compound is 1-(1H-indol-2-yl)-N-methylethanamine.
What is the InChI representation of the compound?
The InChI representation of the compound is InChI=1S/C11H14N2/c1-8(12-2)11-7-9-5-3-4-6-10(9)13-11/h3-8,12-13H,1-2H3.
What is the InChIKey of the compound?
The InChIKey of the compound is KLFJXADECANLNB-UHFFFAOYSA-N.
What is the Canonical SMILES representation of the compound?
The Canonical SMILES representation of the compound is CC(C1=CC2=CC=CC=C2N1)NC.
How many hydrogen bond donor counts does the compound have?
The compound has 2 hydrogen bond donor counts.
What is the XLogP3 value of the compound?
The XLogP3 value of the compound is 1.9.
What is the exact mass of the compound?
The exact mass of the compound is 174.115698455 g/mol.
Is the compound canonicalized?
Yes, the compound is canonicalized.
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CAS
96287-28-4 Purity
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96287-28-4 Purity
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