AG009B2S

141849-62-9 | 3-Phenylthiomorpholine

AG009B2S

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CAS Number	141849-62-9
Catalog Number	AG009B2S(AGN-PC-0LFFEP)
Chemical Name	3-Phenylthiomorpholine
IUPAC Name	3-phenylthiomorpholine
InChI	InChI=1S/C10H13NS/c1-2-4-9(5-3-1)10-8-12-7-6-11-10/h1-5,10-11H,6-8H2
InChI Key	JIBMCWSAEWAKIP-UHFFFAOYSA-N
MDL Number	MFCD03002059
Molecular Formula	C10H13NS
Molecular Weight	179.2819
SMILES	C1(C2=CC=CC=C2)NCCSC1
Synonyms	3-Phenylthiomorpholine, 141849-62-9, 3-phenyl thiomorpholine, Thiomorpholine,3-phenyl-, AC1NFKUA, PubChem18206, AC1Q1ICL, ACMC-1C7AC, 3-phenylthiomorpholine95%, 3-phenylthiomorpholine 95%, SCHEMBL2331878, 3-phenyl-1,4-thiazaperhydroine, CTK4C2821, KS-00003KSK, DTXSID30405549, 3-phenylthiomorpholine, AldrichCPR, 3TMA-0-0, 3-Phenyltetrahydro-2H-1,4-thiazine, ANW-51379, MFCD03002059, SBB089579, AKOS006227797, FS-3031, MCULE-6952818312, QC-5059, RTR-005378, VZ27233, AK-21259, AN-31660, BR-21259, AB0022269, DB-042586, ST2410841, TR-005378, 4CH-007165, FT-0643331, W3091, EN300-78974, S-3730, 849P629, I14-10171, Z1269702506, C10H13NS, CID4685153,

Complexity	132
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	179.077g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	179.281g/mol
Monoisotopic Mass	179.077g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	37.3A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	1.7

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

Lot Number