AG00327U

459-05-2 | 1-(4-Fluorophenyl)thiourea

AG00327U

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CAS Number	459-05-2
Catalog Number	AG00327U(AGN-PC-0JV0YY)
Chemical Name	1-(4-Fluorophenyl)thiourea
IUPAC Name	(4-fluorophenyl)thiourea
InChI	InChI=1S/C7H7FN2S/c8-5-1-3-6(4-2-5)10-7(9)11/h1-4H,(H3,9,10,11)
InChI Key	BRWKXKNZRVALNZ-UHFFFAOYSA-N
MDL Number	MFCD00041180
Molecular Formula	C7H7FN2S
Molecular Weight	170.2073
SMILES	S=C(N)NC1=CC=C(F)C=C1
Synonyms	459-05-2, 1-(4-fluorophenyl)thiourea, 1-(4-Fluorophenyl)-2-thiourea, (4-Fluorophenyl)thiourea, 4-fluorophenylthiourea, N-(4-Fluorophenyl)thiourea, p-fluorophenylthiourea, (4-fluoro-phenyl)-thiourea, Thiourea, (4-fluorophenyl)-, BRWKXKNZRVALNZ-UHFFFAOYSA-N, MFCD00041180, amino[(4-fluorophenyl)amino]methane-1-thione, AC1LEVIM, PubChem10059, ACMC-1AJJB, (4-fluorophenyl)-thiourea, (4-Fluoro phenyl)thiourea, 1-(p-Fluorophenyl)thiourea, AC1Q7EK0, KSC490O4P, SCHEMBL145719, N-(4-Fluorophenyl)thiourea #, 1-[p-Fluorophenyl]-2-thiourea, (4-Fluorophenyl)thiourea, 97%, CTK3J0747, ZINC64840, DTXSID30351173, JS-193C, AC1Q5038, BCP24081, EBD26761, HTS027735, SBB038551, STL163598, AKOS000113515, CS-W001574, MCULE-4565995455, RP09084, RTR-017341, TRA0066410, KS-000010I5, AJ-10055, AN-45059, CJ-00526, SC-64669, ZB002484, AB0061903, AB1003959, DB-018584, TR-017341, 4CH-022454, BB 0218383, F0836, FT-0618559, ST24037375, ST45022074, V6038, EN300-14927, K-9050, A826925, AF-399/25108015, I09-1019, J-503318, F1118-0054, C7H7FN2S, AR-1G2363, CID693061, ZINC00064840, (4-Fluorophenyl)thiourea, 98% - 1G 1g, 656-32-6, 67846-64-4, 8P4,

Complexity	143
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	170.031g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	170.205g/mol
Monoisotopic Mass	170.031g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	70.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.6

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	6.1
Hazard statements	H301-H319
Packing Group	Ⅲ
Precautionary statements	P301+P310-P305+P351+P338
Signal Words	danger
UN Code	UN 2811

Certificate of Analysis

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