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(2S)-2-(Acetylamino)-N,3-dimethylbutanamide

(2S)-2-(Acetylamino)-N,3-dimethylbutanamide structure

CAS No:
19701-84-9
Formula:
C8H16N2O2
Chemical Name:
(2S)-2-(Acetylamino)-N,3-dimethylbutanamide
Synonyms:
Butanamide,2-(acetylamino)-N,3-dimethyl-,(2S)-;Butyramide,2-acetamido-N,3-dimethyl-,L-;Butanamide,2-(acetylamino)-N,3-dimethyl-,(S)-;(2S)-2-(Acetylamino)-N,3-dimethylbutanamide;N-Acetyl-L-valine methylamide;2-Acetamido-N,3-dimethyl-L-butyramide;N-Acetyl-N′-methylvalinamide;N-Acetyl-N′-methyl-L-valinamide;N-Acetyl-L-valine N-methylamide;(2S)-2-Acetamido-N,3-dimethylbutanamide

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(2S)-2-(Acetylamino)-N,3-dimethylbutanamide Basic Attributes

Molecular Weight：

172.22500

Exact Mass：

172.22

DSSTox ID：

DTXSID80427190

Characteristics

PSA：

58.20000

XLogP3：

0.67490

Density：

0.994g/cm3

Melting Point：

>250 °C (sublm) @ Solvent: Ethyl acetate

Boiling Point：

402ºC at 760 mmHg

Flash Point：

180.4ºC

Refractive Index：

1.446

Storage Conditions：

Store at RT.

Vapor Pressure：

1.14E-06mmHg at 25°C

Computed Properties

Molecular Weight:172.22
XLogP3:-0.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:172.121177757
Monoisotopic Mass:172.121177757
Topological Polar Surface Area:58.2
Heavy Atom Count:12
Complexity:178
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of (2S)-2-(Acetylamino)-N,3-dimethylbutanamide

Basic Attributes
Characteristics
Computed Properties

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