AG00EBNE

5892-99-9 | N,N-Diethyl 4-bromobenzamide

AG00EBNE

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CAS Number	5892-99-9
Catalog Number	AG00EBNE(AGN-PC-0LC79C)
Chemical Name	N,N-Diethyl 4-bromobenzamide
IUPAC Name	4-bromo-N,N-diethylbenzamide
InChI	InChI=1S/C11H14BrNO/c1-3-13(4-2)11(14)9-5-7-10(12)8-6-9/h5-8H,3-4H2,1-2H3
InChI Key	LDUPVXSXLZOQAF-UHFFFAOYSA-N
MDL Number	MFCD00463697
Molecular Formula	C11H14BrNO
Molecular Weight	256.1390
SMILES	O=C(N(CC)CC)C1=CC=C(Br)C=C1
Synonyms	4-bromo-N,N-diethylbenzamide, 5892-99-9, n,n-diethyl 4-bromobenzamide, N,N-Diethyl-4-bromobenzamide, LDUPVXSXLZOQAF-UHFFFAOYSA-N, ACMC-1AYAN, AC1NBRK1, n,n-diethyl-p-bromobenzamide, 4-bromo-n,n-diethyl benzamide, N, N-diethyl-4-bromobenzamide, N,N-diethyl-4-bromo-benzamide, SCHEMBL1934529, CTK5A9104, DTXSID90403723, 4-bromanyl-N,N-diethyl-benzamide, Benzamide, 4-bromo-N,N-diethyl-, ZINC5313877, ANW-33078, KM0262, MFCD00463697, AKOS000173229, AM87082, PS-3503, KS-000029Y7, AJ-53782, TR-020452, FT-0717168, V6796, A832079, I01-11074, C11H14BrNO, 4-bromo-N,N-diethyl-benzamide, CID4498254,

Complexity	184
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	255.026g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	256.143g/mol
Monoisotopic Mass	255.026g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	20.3A^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-H315-H319-H335
Packing Group
Precautionary statements	P261-P301+P312-P302+P352-P304+P340-P305+P351+P338
UN Code

Certificate of Analysis

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