AG0038YF

1208-87-3 | (4-(Chloromethyl)phenyl)(phenyl)sulfane

AG0038YF

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CAS Number	1208-87-3
Catalog Number	AG0038YF(AGN-PC-0JLA33)
Chemical Name	(4-(Chloromethyl)phenyl)(phenyl)sulfane
EC Number	214-903-4
IUPAC Name	1-(chloromethyl)-4-phenylsulfanylbenzene
InChI	InChI=1S/C13H11ClS/c14-10-11-6-8-13(9-7-11)15-12-4-2-1-3-5-12/h1-9H,10H2
InChI Key	RLFHPRWHJYDGSD-UHFFFAOYSA-N
MDL Number	MFCD09907764
Molecular Formula	C13H11ClS
Molecular Weight	234.7444
NSC Number	43056
SMILES	ClCC1=CC=C(C=C1)SC1=CC=CC=C1
Synonyms	1208-87-3, (4-(Chloromethyl)phenyl)(phenyl)sulfane, 1-(Chloromethyl)-4-(phenylthio)benzene, 1-(chloromethyl)-4-phenylsulfanylbenzene, 4-Phenylthio Benzyl Chloride, 4-(Phenylthio)benzyl chloride, AK117122, NSC43056, EINECS 214-903-4, 4-(chloromethyl)phenyl phenyl sulfide, PubChem10750, AC1L2FDV, AC1Q3UDA, SCHEMBL2994386, CTK0H6236, DTXSID30153018, RLFHPRWHJYDGSD-UHFFFAOYSA-N, 1-chloromethyl-4-phenylthiobenzene, ACT06253, ZINC1675829, MFCD09907764, NSC-43056, 1-Chloromethyl-4-(phenylthio)benzene, AKOS015888812, RP28146, AJ-29412, SC-27758, 1-(Chloromethyl)-4-(phenylsulfanyl)benzene, FT-0655308, ST24034558, I01-1530, I01-1725, C13H11ClS, C13-H11-Cl-S, CID71022, AR-1F6787, 6317-56-2, 122215-75-2,

Complexity	169
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	234.027g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	234.741g/mol
Monoisotopic Mass	234.027g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	25.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	4.4

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

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