AG003P4Q

Name: Cyclohexanemethyl isothiocyanate
Brand: Angene Chemical
SKU: AG003P4Q

52395-66-1 | Cyclohexanemethyl isothiocyanate

AG003P4Q

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CAS Number	52395-66-1
Catalog Number	AG003P4Q(AGN-PC-0JMSXN)
Chemical Name	Cyclohexanemethyl isothiocyanate
IUPAC Name	isothiocyanatomethylcyclohexane
InChI	InChI=1S/C8H13NS/c10-7-9-6-8-4-2-1-3-5-8/h8H,1-6H2
InChI Key	RYBJNWIQNLZNPE-UHFFFAOYSA-N
MDL Number	MFCD00040881
Molecular Formula	C8H13NS
Molecular Weight	155.2605
NSC Number	400136
SMILES	C1CCC(CC1)CN=C=S
Synonyms	Cyclohexanemethyl isothiocyanate, Cyclohexylmethyl isothiocyanate, 52395-66-1, (Isothiocyanatomethyl)cyclohexane, RYBJNWIQNLZNPE-UHFFFAOYSA-N, MFCD00040881, NSC400136, AC1Q7EYJ, AC1L3M3R, cyclohexylmethanisothiocyanate, isothiocyanatomethylcyclohexane, SCHEMBL1448756, CHEMBL2151142, DTXSID80200405, (Isothiocyanatomethyl)cyclohexane #, ZINC1593014, 4897AE, Cyclohexylmethyl isothiocyanate, 97%, AKOS009159137, MCULE-2178824617, NE29757, NSC-400136, BP-12936, CJ-25514, FT-0624231, ST50824521, EN300-61597, I14-59535, C8H13NS, CID142928,

Complexity	132
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	155.077g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	155.259g/mol
Monoisotopic Mass	155.077g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	44.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	4

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