Carbamic acid, [(1S)-3-hydroxy-1-(hydroxymethyl)propyl]-,1,1-dimethylethyl ester


Chemical Name: Carbamic acid, [(1S)-3-hydroxy-1-(hydroxymethyl)propyl]-,1,1-dimethylethyl ester
CAS Number: 128427-10-1
Product Number: AG000Y3F(AGN-PC-0PIR9T)
Synonyms:
MDL No: MFCD03093946
Molecular Formula: C9H19NO4
Molecular Weight: 205.2515

Identification/Properties


Properties
MP:
65-69 °C(lit.)
BP:
365°C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
205.254g/mol
XLogP3:
0
Hydrogen Bond Donor Count:
3
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
6
Exact Mass:
205.131g/mol
Monoisotopic Mass:
205.131g/mol
Topological Polar Surface Area:
78.8A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
176
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
1
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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