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Structure

Acetic-1-13c acid

CAS
1563-79-7
Catalog Number
ACM1563797
Category
Other Products
Molecular Weight
61.06
Molecular Formula
C2H4O2

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Specification

Synonyms
ACETIC ACID (1-13C);ACETIC-1-13C ACID;ACETIC-1-13C ACID, 99 ATOM % 13C;(1-13C)Acetic acid 99 atom % 13C;(1-13C)Ethanoic acid;D4, 98%);Acetic acid-1-13C
Boiling Point
117-118°C(lit.)
Melting Point
16.2°C(lit.)
Flash Point
104°F
Density
1.066g/mL at 25°C
Hazard Statements
C
Safety Description
23-26-45
Supplemental Hazard Statements
H226-H290-H314
Symbol
GHS02,GHS05
What is the molecular formula of acetic-1-13c acid according to the reference?

The molecular formula of acetic-1-13c acid is C2H4O2.

What is the IUPAC Name of acetic-1-13c acid?

The IUPAC Name of acetic-1-13c acid is acetic acid.

What is the InChIKey of acetic-1-13c acid?

The InChIKey of acetic-1-13c acid is QTBSBXVTEAMEQO-VQEHIDDOSA-N.

What is the Canonical SMILES of acetic-1-13c acid?

The Canonical SMILES of acetic-1-13c acid is CC(=O)O.

How many Hydrogen Bond Donor Count does acetic-1-13c acid have?

Acetic-1-13c acid has 1 Hydrogen Bond Donor Count.

What is the Topological Polar Surface Area of acetic-1-13c acid?

The Topological Polar Surface Area of acetic-1-13c acid is 37.3 Å^2.

How many Heavy Atoms does acetic-1-13c acid contain?

Acetic-1-13c acid contains 4 Heavy Atoms.

Is the Compound Is Canonicalized value for acetic-1-13c acid Yes or No?

The Compound Is Canonicalized value for acetic-1-13c acid is Yes.

What is the exact molecular weight of acetic-1-13c acid?

The exact molecular weight of acetic-1-13c acid is 61.045 g/mol.

What is the CAS number for acetic-1-13c acid?

The CAS number for acetic-1-13c acid is 1563-79-7.

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