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4-isocyanotetrahydropyran - 97%, high purity , CAS No.1000699-00-2

COA

Grade & Purity:

≥97%

Cas Number: 1000699-00-2
Molecular Weight: 111.14
EC Number: 834-750-2
MDL number: MFCD25953977
PubChem CID: 82650930

In stock

Item Number

I637354

Grouped product items
SKU	Size	Availability	Price	Qty
I637354-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$161.90

Basic Description

Synonyms	AC9405 \| Z1725967213 \| 4-Isocyanotetrahydro-2H-pyran \| 4-Isocyanotetrahydro-2H-pyran, AldrichCPR \| EN300-312281 \| SY263033 \| GS-0381 \| 4-isocyanooxane \| 1000699-00-2 \| SCHEMBL361418 \| MFCD25953977 \| AKOS022965593
Specifications & Purity	≥97%
Shipped In	Normal

Names and Identifiers

IUPAC Name	4-isocyanooxane
INCHI	InChI=1S/C6H9NO/c1-7-6-2-4-8-5-3-6/h6H,2-5H2
InChIKey	NEOIPTGICFBMEE-UHFFFAOYSA-N
Smiles	[C-]#[N+]C1CCOCC1
Isomeric SMILES	[C-]#[N+]C1CCOCC1
Alternate CAS	1000699-00-2
PubChem CID	82650930
Molecular Weight	111.14

Certificates（CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	111.140 g/mol
XLogP3	0.300
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Exact Mass	111.068 Da
Monoisotopic Mass	111.068 Da
Topological Polar Surface Area	13.600 Å²
Heavy Atom Count	8
Formal Charge	0
Complexity	107.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
The total count of all stereochemical bonds	0
Covalently-Bonded Unit Count	1

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