AG003JXM

27913-96-8 | 4-(1,1-Dioxidothiomorpholino)benzaldehyde

AG003JXM

SDS

COA

Price

$0.00

Add to Cart

Buy Now

WARNING This product is not for human or veterinary use.

CAS Number	27913-96-8
Catalog Number	AG003JXM(AGN-PC-0R3LBA)
Chemical Name	4-(1,1-Dioxidothiomorpholino)benzaldehyde
IUPAC Name	4-(1,1-dioxo-1,4-thiazinan-4-yl)benzaldehyde
InChI	InChI=1S/C11H13NO3S/c13-9-10-1-3-11(4-2-10)12-5-7-16(14,15)8-6-12/h1-4,9H,5-8H2
InChI Key	JCYZHXMHEACSIN-UHFFFAOYSA-N
MDL Number	MFCD08276340
Molecular Formula	C11H13NO3S
Molecular Weight	239.2908
SMILES	O=CC1=CC=C(N(CC2)CCS2(=O)=O)C=C1
Synonyms	4-(1,1-Dioxothiomorpholino)benzaldehyde, 27913-96-8, 4-(1,1-Dioxidothiomorpholino)benzaldehyde, ACMC-1CF1W, SCHEMBL208973, CTK4G0419, DTXSID10656198, JCYZHXMHEACSIN-UHFFFAOYSA-N, KS-000014RX, ANW-26288, MFCD08276340, ZINC12956568, ACM27913968, CC-16141, DB-047299, TC-115033, D3162, FT-0638733, 4-(4-Formylphenyl)thiomorpholine 1,1-Dioxide, 4-(1,1-dioxo-1,4-thiazinan-4-yl)benzaldehyde, Benzaldehyde,4-(1,1-dioxido-4-thiomorpholinyl)-, C-14295, 4-(1,1-Dioxido-4-thiomorpholinyl)benzaldehyde, AldrichCPR, 4-(1,1-Dioxo-1lambda~6~,4-thiazinan-4-yl)benzaldehyde, 4- benzaldehyde,

Complexity	325
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	239.062g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	239.289g/mol
Monoisotopic Mass	239.062g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	62.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number