1H-Inden-1-amine, 2,3-dihydro-N-2-propynyl-, (1R)-, methanesulfonate


Chemical Name: 1H-Inden-1-amine, 2,3-dihydro-N-2-propynyl-, (1R)-, methanesulfonate
CAS Number: 161735-79-1
Product Number: AG001VUM(AGN-PC-0O4MEW)
Synonyms:
MDL No:
Molecular Formula: C13H17NO3S
Molecular Weight: 267.3440

Identification/Properties


Computed Properties
Molecular Weight:
267.343g/mol
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
2
Exact Mass:
267.093g/mol
Monoisotopic Mass:
267.093g/mol
Topological Polar Surface Area:
74.8A^2
Heavy Atom Count:
18
Formal Charge:
0
Complexity:
305
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:
2
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H302
Precautionary Statements:
P280-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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