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Home> Encyclopedia > Hot Product Listed 1   > 1,2-Propanediol,3-[(1,1-dimethylethyl)amino]-, (2S)-
30315-46-9 structure

1,2-Propanediol,3-[(1,1-dimethylethyl)amino]-, (2S)-

Iupac Name:(2S)-3-(tert-butylamino)propane-1,2-diol
CAS No.:30315-46-9
EINECS(EC#): 250-125-1
Molecular Weight:147.218
Molecular Formula:C7H17NO2 (isomer)
Properties
Appearance
white flakes or powder
Density
0.992
Melting Point
85-89℃
Boiling Point
262.4 ºC at 760 mmHg
Refractive Index
-29 ° (C=2, 1mol/L HCl)
Flash Point
109.1 ºC
Alpha
-30 º(C=1,1N HCL)
HS Code
2922199090
Safety and Handling
Hazard Codes
Xn
Risk Statements
R20/21/22
Safety Statements
S24/25
Safety

Safety Information of (S)-3-tert-Butylamino-1,2-propanediol (CAS NO.30315-46-9):
Hazard Codes: HarmfulXn
Risk Statements: 20/21/22-36/37/38 
R20/21/22:Harmful by inhalation, in contact with skin and if swallowed. 
R36/37/38:Irritating to eyes, respiratory system and skin.
Safety Statements: 24/25-36-26 
S24/25:Avoid contact with skin and eyes. 
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. 
S36:Wear suitable protective clothing.
WGK Germany: 3

Specification

  (S)-3-tert-Butylamino-1,2-propanediol (CAS NO.30315-46-9), its Synonyms are 1,2-Propanediol,3-[(1,1-dimethylethyl)amino]-, (2S)- ; 1,2-Propanediol,3-(tert-butylamino)-, (S)-(-)- (8CI) ; 1,2-Propanediol,3-[(1,1-dimethylethyl)amino]-, (S)- ; (S)-1-tert-Butylamino-2,3-propanediol .

MSDS

2.Hazard identification

2.1 Classification of the substance or mixture

Not classified.

2.2 GHS label elements, including precautionary statements

Pictogram(s) No symbol.
Signal word

No signal word.

Hazard statement(s)

none

Precautionary statement(s)
Prevention

none

Response

none

Storage

none

Disposal

none

2.3 Other hazards which do not result in classification

none

Precursor and Product
Computational chemical data
  • Molecular Weight:147.218g/mol
  • Molecular Formula:C7H17NO2
  • Compound Is Canonicalized:True
  • Exact Mass:147.126
  • Monoisotopic Mass:147.126
  • Complexity:88.1
  • Rotatable Bond Count:4
  • Hydrogen Bond Donor Count:3
  • Hydrogen Bond Acceptor Count:3
  • Topological Polar Surface Area:52.5A^2
  • Heavy Atom Count:10
  • Defined Atom Stereocenter Count:1
  • Undefined Atom Stereocenter Count:0
  • Defined Bond Stereocenter Count:0
  • Undefined Bond Stereocenter Count:0
  • Isotope Atom Count:0
  • Covalently-Bonded Unit Count:1
  • CACTVS Substructure Key Fingerprint: AAADceBiMAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAHgAQCAAADJzhgAYCAALAAgAA AAAAAAAAAAAAAAAAAIAIAAADEAAAAAAEQAACEACRAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA AA==
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