AG003KVU

56746-19-1 | 4-Bromo-2,6-diethylaniline

AG003KVU

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CAS Number	56746-19-1
Catalog Number	AG003KVU(AGN-PC-0JTRS3)
Chemical Name	4-Bromo-2,6-diethylaniline
IUPAC Name	4-bromo-2,6-diethylaniline
InChI	InChI=1S/C10H14BrN/c1-3-7-5-9(11)6-8(4-2)10(7)12/h5-6H,3-4,12H2,1-2H3
InChI Key	BEJYDMQQZUACPW-UHFFFAOYSA-N
MDL Number	MFCD00059266
Molecular Formula	C10H14BrN
Molecular Weight	228.1289
SMILES	NC1=C(CC)C=C(Br)C=C1CC
Synonyms	4-Bromo-2,6-diethylaniline, 56746-19-1, 2,6-Diethyl-4-bromoaniline, (4-bromo-2,6-diethylphenyl)amine, BEJYDMQQZUACPW-UHFFFAOYSA-N, Benzenamine,4-bromo-2,6-diethyl-, benzenamine, 4-bromo-2,6-diethyl-, PubChem12488, AC1LD3JO, ACMC-1AYA3, AC1Q2TA6, SCHEMBL637010, BEJYDMQQZUACPW-UHFFFAOYSA-, CTK5A5646, 4-bromo-2,6-diethyl-phenylamine, DTXSID40346353, ALBB-010532, ZINC2522773, 8304AB, ANW-32572, MFCD00059266, 4-Bromo-2,6-diethylaniline; >98%, AKOS005172657, AM62034, FS-4228, MCULE-7599720187, VZ28432, AC-27863, AJ-37235, BC003659, SC-17929, DB-052963, TC-121317, B1284, FT-0640408, R1877, A19782, I05-964, InChI=1/C10H14BrN/c1-3-7-5-9(11)6-8(4-2)10(7)12/h5-6H,3-4,12H2,1-2H3, C10H14BrN, CID611452, ZINC02522773,

Complexity	124
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	227.031g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	228.133g/mol
Monoisotopic Mass	227.031g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	26A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.5

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H312-H315-H319-H332
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

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