CAS
94160-14-2 Purity
96%
94160-14-2 Purity
96%
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Heptyl N-acetyl-dl-methionate
CAS
94160-17-5
Catalog Number
ACM94160175
Category
Other Products
Molecular Weight
289.434080 [g/mol]
Molecular Formula
C14H27NO3S
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Specification
Synonyms
Heptyl N-acetyl-DL-methionate, EINECS 303-299-9, 94160-17-5
IUPAC Name
heptyl 2-acetamido-4-methylsulfanylbutanoate
Canonical SMILES
CCCCCCCOC(=O)C(CCSC)NC(=O)C
InChI Key
ITAMPCRWHBHHPJ-UHFFFAOYSA-N
Boiling Point
442.7ºC at 760 mmHg
Flash Point
221.5ºC
Density
1.021g/cm³
EC Number
303-299-9
Exact Mass
289.17100
H-Bond Acceptor
3
H-Bond Donor
1
What is the molecular formula of Heptyl N-acetyl-dl-methionate?
The molecular formula of Heptyl N-acetyl-dl-methionate is C14H27NO3S.
What are some synonyms for Heptyl N-acetyl-dl-methionate?
Some synonyms for Heptyl N-acetyl-dl-methionate are Heptyl N-acetyl-DL-methionate and N-[1-(Heptyloxy)-4-(methylsulfanyl)-1-oxobutan-2-yl]ethanimidic acid.
When was Heptyl N-acetyl-dl-methionate created on PubChem?
Heptyl N-acetyl-dl-methionate was created on August 20, 2009, on PubChem.
What is the InChIKey of Heptyl N-acetyl-dl-methionate?
The InChIKey of Heptyl N-acetyl-dl-methionate is ITAMPCRWHBHHPJ-UHFFFAOYSA-N.
How many hydrogen bond donor counts does Heptyl N-acetyl-dl-methionate have?
Heptyl N-acetyl-dl-methionate has 1 hydrogen bond donor count.
What is the topological polar surface area of Heptyl N-acetyl-dl-methionate?
The topological polar surface area of Heptyl N-acetyl-dl-methionate is 80.7 Ų.
How many rotatable bond counts does Heptyl N-acetyl-dl-methionate have?
Heptyl N-acetyl-dl-methionate has 12 rotatable bond counts.
Is Heptyl N-acetyl-dl-methionate a canonicalized compound?
Yes, Heptyl N-acetyl-dl-methionate is a canonicalized compound.
What is the molecular weight of Heptyl N-acetyl-dl-methionate?
The molecular weight of Heptyl N-acetyl-dl-methionate is 289.44 g/mol.
What is the formal charge of Heptyl N-acetyl-dl-methionate?
The formal charge of Heptyl N-acetyl-dl-methionate is 0.
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