AG00EIF9

57120-36-2 | 4-(tert-Butoxy)aniline

AG00EIF9

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CAS Number	57120-36-2
Catalog Number	AG00EIF9(AGN-PC-0NGV9L)
Chemical Name	4-(tert-Butoxy)aniline
IUPAC Name	4-[(2-methylpropan-2-yl)oxy]aniline
InChI	InChI=1S/C10H15NO/c1-10(2,3)12-9-6-4-8(11)5-7-9/h4-7H,11H2,1-3H3
InChI Key	NJLJXOXRYXXBOF-UHFFFAOYSA-N
MDL Number	MFCD11196184
Molecular Formula	C10H15NO
Molecular Weight	165.2322
SMILES	NC1=CC=C(OC(C)(C)C)C=C1
Synonyms	4-(tert-Butoxy)aniline, 4-TERT-BUTOXYANILINE, 57120-36-2, 4-[(2-methylpropan-2-yl)oxy]aniline, ACMC-209lw5, SCHEMBL292991, CTK5A6330, DTXSID80457179, 4-tert-Butoxyaniline, AldrichCPR, NJLJXOXRYXXBOF-UHFFFAOYSA-N, ANW-32643, MFCD11196184, ZINC20507021, AKOS009257565, MCULE-4420447365, AJ-77833, AS-44498, CJ-16773, TR-037128, FT-0759439, ST24023245, V6697, EN300-85583, B-8213, I14-25099, F0001-1492, Z1259162033, C10H15NO, CID11159518,

Complexity	131
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	165.115g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	165.236g/mol
Monoisotopic Mass	165.115g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	35.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.9

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H317
Packing Group
Precautionary statements	P280
UN Code

Certificate of Analysis

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