2-Butene-1-thiol, 3-methyl-


Chemical Name: 2-Butene-1-thiol, 3-methyl-
CAS Number: 5287-45-6
Product Number: AG00DAII(AGN-PC-07A22X)
Synonyms:
MDL No:
Molecular Formula: C5H10S
Molecular Weight: 102.1979

Identification/Properties


Properties
Storage:
-10 ℃;
Computed Properties
Molecular Weight:
102.195g/mol
XLogP3:
2
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
1
Exact Mass:
102.05g/mol
Monoisotopic Mass:
102.05g/mol
Topological Polar Surface Area:
1A^2
Heavy Atom Count:
6
Formal Charge:
0
Complexity:
51
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
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:
Danger
UN#:
3336
Hazard Statements:
H226
Precautionary Statements:
P501-P240-P210-P233-P243-P241-P242-P280-P370+P378-P303+P361+P353-P403+P235
Class:
3
Packing Group:

NMR Spectrum


Other Analytical Data


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