AG01BUTI

Name: 4-Isocyanooxane
Brand: Angene Chemical
SKU: AG01BUTI

1000699-00-2 | 4-Isocyanooxane

AG01BUTI

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WARNING This product is not for human or veterinary use.

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CAS Number	1000699-00-2
Catalog Number	AG01BUTI
Chemical Name	4-Isocyanooxane
IUPAC Name	4-isocyanooxane
InChI	InChI=1S/C6H9NO/c1-7-6-2-4-8-5-3-6/h6H,2-5H2
InChI Key	NEOIPTGICFBMEE-UHFFFAOYSA-N
MDL Number	MFCD25953977
Molecular Formula	C6H9NO
Molecular Weight	111.1418
SMILES	[N+](#[C-])C1CCOCC1
Synonyms	4-isocyanooxane, 4-isocyano-tetrahydro-pyran, 1000699-00-2, SCHEMBL361418, AKOS022965593, ZINC106165808, 4-Isocyanotetrahydro-2H-pyran, AldrichCPR, Z2756136956,

Complexity	107
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	111.068g/mol
Formal Charge	0
Heavy Atom Count	8
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	111.144g/mol
Monoisotopic Mass	111.068g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	13.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.3

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