AG008RQ0

Name: 1-Cyclopentyl-1-tosylmethyl isocyanide
Brand: Angene Chemical
SKU: AG008RQ0

1048971-66-9 | 1-Cyclopentyl-1-tosylmethyl isocyanide

AG008RQ0

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CAS Number	1048971-66-9
Catalog Number	AG008RQ0(AGN-PC-0WBOBH)
Chemical Name	1-Cyclopentyl-1-tosylmethyl isocyanide
IUPAC Name	1-[cyclopentyl(isocyano)methyl]sulfonyl-4-methylbenzene
InChI	InChI=1S/C14H17NO2S/c1-11-7-9-13(10-8-11)18(16,17)14(15-2)12-5-3-4-6-12/h7-10,12,14H,3-6H2,1H3
InChI Key	SNBRQNBTPMQAPH-UHFFFAOYSA-N
MDL Number	MFCD04114804
Molecular Formula	C14H17NO2S
Molecular Weight	263.3553
SMILES	Cc1ccc(cc1)S(=O)(=O)C([N+]#[C-])C1CCCC1
Synonyms	1-CYCLOPENTYL-1-TOSYLMETHYL ISOCYANIDE, 1048971-66-9, 1-((CYCLOPENTYL(ISOCYANO)METHYL)SULFONYL)-4-METHYLBENZENE, C14H17NO2S, MFCD04114804, 1-{[cyclopentyl(isocyano)methyl]sulfonyl}-4-methylbenzene, SIN-0423, ZX-BK001805, 4701AH, BBL021286, STK893992, AKOS005144580, AB19028, K-0442, J-001287, 1-(Cyclopentylisocyanomethylsulfonyl)-4-methylbenzene, 1-cyclopentyl(isocyano)methanesulfonyl-4-methylbenzene,

Complexity	414
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	263.098g/mol
Formal Charge	0
Heavy Atom Count	18
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	263.355g/mol
Monoisotopic Mass	263.098g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	46.9A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	3.2

CERTIFICATE OF ANALYSIS

Analysis Data:

Test:

Result:

Conclusion: The above product meets the specifications of Angene.

Analyst:Chase

Date:

Reviewed by:Jessie

Date:

Angene International Limited