AG00345I

2396-68-1 | 4-TERT-BUTYLTHIOPHENOL

AG00345I

SDS

COA

Price

$0.00

WARNING This product is not for human or veterinary use.

CAS Number	2396-68-1
Catalog Number	AG00345I(AGN-PC-0JLPD9)
Chemical Name	4-TERT-BUTYLTHIOPHENOL
EC Number	219-255-6
IUPAC Name	4-tert-butylbenzenethiol
InChI	InChI=1S/C10H14S/c1-10(2,3)8-4-6-9(11)7-5-8/h4-7,11H,1-3H3
InChI Key	GNXBFFHXJDZGEK-UHFFFAOYSA-N
MDL Number	MFCD00022067
Molecular Formula	C10H14S
Molecular Weight	166.2832
SMILES	c1cc(ccc1C(C)(C)C)S
Synonyms	4-tert-Butylthiophenol, 4-tert-Butylbenzenethiol, 2396-68-1, p-tert-Butylthiophenol, p-tert-Butylbenzenethiol, Benzenethiol, p-tert-butyl-, p-t-Butylthiophenol, p-tert-Butylphenyl mercaptan, Benzenethiol, 4-(1,1-dimethylethyl)-, Benzenethiol, p-tert-butylthio-, 4-(tert-butyl)thiophenol, NSC 26804, 4-t-butylthiophenol, EINECS 219-255-6, 4-tert-butyl-benzenethiol, NSC 57807, BRN 0606476, 4-tert-butylbenzene-1-thiol, AI3-26176, GNXBFFHXJDZGEK-UHFFFAOYSA-N, MFCD00022067, Benzenethiol,1-dimethylethyl)-, WLN: SHR DX1&1&1, 4-(tert-Butyl)benzenethiol, p-t-butyl thiophenol, 4-tertbutylthiophenol, 4-t-butyl-thiophenol, 4-t-butylbenzenethiol, para-t-butylthiophenol, PubChem6846, 4-tert-butylbenzenthiol, para-t-butyl-thiophenol, 4-tert. butylthiophenol, 4-tert.butyl-thiophenol, AC1L2OSI, p-(tert-butyl)thiophenol, para-(t-butyl)thiophenol, 4-tert-butyl benzenethiol, 4-tert. butyl-thiophenol, para-(t-butyl)-thiophenol, ACMC-209g7e, DSSTox_CID_28171, DSSTox_RID_82732, DSSTox_GSID_48196, SCHEMBL67741, 4-06-00-03316 (Beilstein Handbook Reference), 4-tert-Butylbenzenethiol, 97%, CHEMBL3186499, DTXSID9048196, CTK1A2112, 4-(1,1-Dimethylethyl)Benzenethiol, KS-00000WO0, NSC26804, NSC57807, Tox21_303557, ANW-25272, NSC-26804, NSC-57807, NSC229514, ZINC19850667, AKOS009031102, MCULE-6718278079, NSC-229514, PS-8737, RP22942, TRA0070191, NCGC00257390-01, AN-50821, LS-32188, SC-02777, U707, CAS-2396-68-1, DB-046305, RT-001253, TL8006764, B0741, FT-0082327, FT-0634245, Benzenethiol, 4-(1,1-dimethylethyl)- (9CI), K-6483, J-015294, J-516010, F0001-0819, p-tert-butyl-thiophenol, C10H14S, 4-(tert-butyl)benzene-1-thiol, CID75454, C10-H14-S, 4-tert-Butylthiophenol, 98% - 1G 1g,

Complexity	115
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	166.082g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	166.282g/mol
Monoisotopic Mass	166.082g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.8

GHS Hazard and Precautionary Statements

Symbol:
Hazard statements	H315-H319-H335
Precuationary statements	P261-P305+P351+P338
Siginal words

Certificate of Analysis

Lot Number