CAS
91551-85-8 Purity
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91551-85-8 Purity
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3-(2,6-Dimethylphenoxy)-N-methyl-1-propanamine x1hcl
CAS
91553-71-8
Catalog Number
ACM91553718
Category
Other Products
Molecular Weight
193.285360 [g/mol]
Molecular Formula
C12H19NO
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Specification
Synonyms
Ambcb9071460, AGN-PC-01MP6F, SureCN7700722, CTK5G9800, MolPort-005-262-961, AKOS009272420, AG-H-75746, 3-(2,6-dimethylphenoxy)-N-methylpropan-1-amine, 3-(2,6-DIMETHYLPHENOXY)-N-METHYL-1-PROPANAMINE, 91553-71-8
IUPAC Name
3-(2,6-dimethylphenoxy)-N-methylpropan-1-amine
Canonical SMILES
CC1=C(C(=CC=C1)C)OCCCNC
InChI Key
RDQDLPIZJMQZCI-UHFFFAOYSA-N
Boiling Point
291.4ºC at 760 mmHg
Flash Point
120.1ºC
Density
0.946g/cm³
Exact Mass
193.14700
H-Bond Acceptor
2
H-Bond Donor
1
What is the chemical name of the keyword mentioned in the reference?
The chemical name of the keyword mentioned in the reference is 3-(2,6-dimethylphenoxy)-N-methylpropan-1-amine.
What is the molecular formula of the keyword?
The molecular formula of the keyword is C12H19NO.
What is the molecular weight of the keyword?
The molecular weight of the keyword is 193.28 g/mol.
What is the InChIKey of the keyword?
The InChIKey of the keyword is RDQDLPIZJMQZCI-UHFFFAOYSA-N.
How many hydrogen bond donor counts does the keyword have?
The keyword has 1 hydrogen bond donor count.
What is the exact mass of the keyword?
The exact mass of the keyword is 193.146664230 g/mol.
How many rotatable bond counts does the keyword have?
The keyword has 5 rotatable bond counts.
What is the topological polar surface area of the keyword?
The topological polar surface area of the keyword is 21.3 Ų.
How many heavy atoms are present in the keyword?
There are 14 heavy atoms present in the keyword.
Is the keyword compound canonicalized?
Yes, the keyword compound is canonicalized according to PubChem (release 2021.05.07).
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