AG000WF2

126930-72-1 | Benzene, 1-bromo-4-dodecyl-

AG000WF2

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CAS Number	126930-72-1
Catalog Number	AG000WF2(AGN-PC-003U29)
Chemical Name	Benzene, 1-bromo-4-dodecyl-
IUPAC Name	1-bromo-4-dodecylbenzene
InChI	InChI=1S/C18H29Br/c1-2-3-4-5-6-7-8-9-10-11-12-17-13-15-18(19)16-14-17/h13-16H,2-12H2,1H3
InChI Key	RFFMRBISTZHCNY-UHFFFAOYSA-N
MDL Number	MFCD00191386
Molecular Formula	C18H29Br
Molecular Weight	325.3269
SMILES	CCCCCCCCCCCCC1=CC=C(Br)C=C1
Synonyms	1-Bromo-4-dodecylbenzene, 126930-72-1, 4-Dodecylbromobenzene, 1-bromo-4-n-dodecylbenzene, Benzene, 1-bromo-4-dodecyl-, 4-n-Decylbromobenzene, MFCD00191386, AK122009, 4-bromododecylbenzene, PubChem22735, ACMC-209bby, 1-bromo-4-dodecyl-benzene, KSC494G6D, 4-N-DODECYLBROMOBENZENE, AMBZ0013, SCHEMBL1021920, CTK3J4361, DTXSID20568511, RFFMRBISTZHCNY-UHFFFAOYSA-N, ZINC2556804, 5291AA, ANW-18956, AKOS015835625, DS-6414, RTR-003901, KS-00000M79, AN-32542, BC004820, AB0054828, AX8057474, TR-003901, AM20020357, FT-0725617, 930B721, I14-31926, C18H29Br, R503, B1612, B1802, 1-Bromo-4-n-dodecylbenzene, 95% - 1G 1g,

Complexity	182
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	324.145g/mol
Formal Charge	0
Heavy Atom Count	19
Hydrogen Bond Acceptor Count	0
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	325.334g/mol
Monoisotopic Mass	324.145g/mol
Rotatable Bond Count	11
Topological Polar Surface Area	0A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	8.6

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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