AG003K8G

39905-57-2 | P-HEXYLOXYANILINE

AG003K8G

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CAS Number	39905-57-2
Catalog Number	AG003K8G(AGN-PC-0JKQ7Y)
Chemical Name	P-HEXYLOXYANILINE
EC Number	254-696-8
IUPAC Name	4-hexoxyaniline
InChI	InChI=1S/C12H19NO/c1-2-3-4-5-10-14-12-8-6-11(13)7-9-12/h6-9H,2-5,10,13H2,1H3
InChI Key	DJRKHTCUXRGYEU-UHFFFAOYSA-N
MDL Number	MFCD00007868
Molecular Formula	C12H19NO
Molecular Weight	193.2854
SMILES	NC1=CC=C(OCCCCCC)C=C1
UNII	VMX449YP3L
Synonyms	4-hexyloxyaniline, HOA, 4-(Hexyloxy)aniline, 4-Hexyloxyaniline, 39905-57-2, p-Hexyloxyaniline, Benzenamine, 4-(hexyloxy)-, 4-n-Hexyloxyaniline, (p-Hexyloxy)aniline, 4-(Hexyloxy)benzenamine, UNII-VMX449YP3L, ANILINE, (p-HEXYLOXY)-, EINECS 254-696-8, BRN 2936950, VMX449YP3L, DJRKHTCUXRGYEU-UHFFFAOYSA-N, 4-hexyloxyphenylamine, GEO-01491, MFCD00007868, FR-0647, W-106398, 4-hexoxyaniline, P-HexYl-Oxyaniline, AC1L1ZLZ, AC1Q2WGO, (4-hexoxy-phenyl)-amine, DSSTox_CID_2288, [4-(hexyloxy)phenyl]amine, Benzenamine,4-(hexyloxy)-, DSSTox_RID_76536, DSSTox_GSID_22288, 3-13-00-00998 (Beilstein Handbook Reference), 4-(Hexyloxy)aniline, 99%, SCHEMBL654792, ARONIS023665, EOS364, Jsp006911, CHEMBL3183372, DTXSID4022288, CTK4I2087, BBB/081, ZINC1670233, ZX-AS003306, 4-hexyloxyaniline (Nominal conc.), Tox21_303490, 5265AB, ANW-44494, BBL023363, SBB007956, STL355044, AKOS000100866, MCULE-1461576794, TRA0005322, VZ35297, ACM39905572, NCGC00257387-01, AJ-29159, AS-46686, CC-33736, CJ-27119, LS-19836, AX8147778, CAS-39905-57-2, ST2405441, TL8002885, TR-015925, AM20040383, FT-0639592, ST50406527, T7791, A24670, C-31178, (p-hexyloxy)-anilin;4-(hexyloxy)-benzenamin;4-(hexyloxy)benzenamine;Aniline, (p-hexyloxy)-, 4-(hexyloxy)phenylamine, C12H19NO, C12-H19-N-O, CID38360, 4-Hexyloxyaniline, 99% - 1G 1g, C072825, HOA,

Complexity	130
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	193.147g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	193.29g/mol
Monoisotopic Mass	193.147g/mol
Rotatable Bond Count	6
Topological Polar Surface Area	35.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	9
Hazard statements	H302+H312+H332-H315-H319-H335-H400
Packing Group	Ⅲ
Precautionary statements	P261-P273-P280-P305+P351+P338
UN Code	UN 3077

Certificate of Analysis

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