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Structure

Trimethyl-3-[(1-oxo-10-undecenyl)amino]propylammonium methyl sulfate

CAS
94313-91-4
Catalog Number
ACM94313914
Category
Other Products
Molecular Weight
394.56972
Molecular Formula
C17H35N2O.CH3O4S

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Specification

Synonyms
94313-91-4, EINECS 304-990-8, AC1MI50X, CTK3I8092, AG-H-89422, methyl sulfate; trimethyl-[3-(undec-10-enoylamino)propyl]azanium, sulfonatooxymethane; trimethyl-[3-(undec-10-enoylamino)propyl]azanium, Trimethyl-3-((1-oxo-10-undecenyl)amino)propylammonium methyl sulphate
IUPAC Name
methyl sulfate;trimethyl-[3-(undec-10-enoylamino)propyl]azanium
Canonical SMILES
C[N+](C)(C)CCCNC(=O)CCCCCCCCC=C.COS(=O)(=O)[O-]
InChI Key
MQMUSWOUVRONBK-UHFFFAOYSA-N
Density
g/cm³
EC Number
304-990-8
Exact Mass
394.25000
H-Bond Acceptor
5
H-Bond Donor
1
What is the molecular formula of Trimethyl-3-[(1-oxo-10-undecenyl)amino]propylammonium methyl sulfate?

The molecular formula is C18H38N2O5S.

What is the molecular weight of Trimethyl-3-[(1-oxo-10-undecenyl)amino]propylammonium methyl sulfate?

The molecular weight is 394.6 g/mol.

What are some synonyms for Trimethyl-3-[(1-oxo-10-undecenyl)amino]propylammonium methyl sulfate?

Some synonyms include 94313-91-4 Trimethyl-3-((1-oxo-10-undecenyl)amino)propylammonium methyl sulphate and trimethyl-[3-(undec-10-enoylamino)propyl]azanium.

When was Trimethyl-3-[(1-oxo-10-undecenyl)amino]propylammonium methyl sulfate created and modified in PubChem?

It was created on 2005-08-09 and modified on 2023-12-30.

What is the IUPAC name of Trimethyl-3-[(1-oxo-10-undecenyl)amino]propylammonium methyl sulfate?

The IUPAC name is methyl sulfate;trimethyl-[3-(undec-10-enoylamino)propyl]azanium.

What is the InChIKey of Trimethyl-3-[(1-oxo-10-undecenyl)amino]propylammonium methyl sulfate?

The InChIKey is MQMUSWOUVRONBK-UHFFFAOYSA-N.

How many hydrogen bond donor counts does Trimethyl-3-[(1-oxo-10-undecenyl)amino]propylammonium methyl sulfate have?

It has 1 hydrogen bond donor count.

What is the exact mass of Trimethyl-3-[(1-oxo-10-undecenyl)amino]propylammonium methyl sulfate?

The exact mass is 394.25014349 g/mol.

How many rotatable bond counts does Trimethyl-3-[(1-oxo-10-undecenyl)amino]propylammonium methyl sulfate have?

It has 13 rotatable bond counts.

Is Trimethyl-3-[(1-oxo-10-undecenyl)amino]propylammonium methyl sulfate a canonicalized compound?

Yes, it is a canonicalized compound.

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