AG00503W

79832-89-6 | 1-Bromo-4-(trans-4-N-pentylcyclohexyl)benzene

AG00503W

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CAS Number	79832-89-6
Catalog Number	AG00503W(AGN-PC-0OIAOI)
Chemical Name	1-Bromo-4-(trans-4-N-pentylcyclohexyl)benzene
IUPAC Name	1-bromo-4-(4-pentylcyclohexyl)benzene
InChI	InChI=1S/C17H25Br/c1-2-3-4-5-14-6-8-15(9-7-14)16-10-12-17(18)13-11-16/h10-15H,2-9H2,1H3
InChI Key	QUWHOIKFJBTGHZ-UHFFFAOYSA-N
MDL Number	MFCD00577359
Molecular Formula	C17H25Br
Molecular Weight	309.2844
SMILES	BrC1=CC=C(C=C1)[C@H]2CC[C@@H](CC2)CCCCC
Synonyms	79832-89-6, 1-Bromo-4-(Trans-4-n-Pentylcyclohexyl)Benzene, 1-Bromo-4-(trans-4-pentylcyclohexyl)benzene, 1-bromo-4-(4-pentylcyclohexyl)benzene, 153873-83-7, Benzene, 1-bromo-4-(4-pentylcyclohexyl)-, 4-PENTYL-CYCLOHEXYL BROMO PHENOL, 1-bromo-4-((1s,4r)-4-pentylcyclohexyl)benzene, Benzene, 1-bromo-4-(trans-4-pentylcyclohexyl)-, 1-(4-bromophenyl)-4-pentylcyclohexane, 1-bromo-4-[(1s,4r)-4-pentylcyclohexyl]benzene, PubChem23593, ACMC-20n6ub, 5CBB, ACMC-209pi9, AC1MY8N5, C17H25Br, KSC496S6L, SCHEMBL223135, SCHEMBL223136, CTK0B1087, CTK3J6965, KS-00000NPW, KS-00001SXH, QUWHOIKFJBTGHZ-SHTZXODSSA-N, ACT02763, ZINC3175434, 4-trans-pentylcyclohexyl bromobenzene, ANW-37327, MFCD00577359, STK027693, AKOS005080838, AKOS015835634, ZINC100004212, ZINC242648376, CB-2075, MCULE-5231897264, RL05078, RTR-025315, VZ21283, 4-(trans-4-pentylcyclohexyl)bromobenzene, AJ-44699, AK-36414, AN-36508, BC004944, BC201141, BR-36414, DA-09913, DS-12929, SC-13363, SY021475, 4-(trans-4-pentylcyclohexy)phenyl bromide, 4-(trans-4-n-pentylcyclohexyl)bromobenzene, AB0026771, DB-005087, ST2415248, TR-025315, 4-(trans-4-n-pentylcyclohexyl) bromobenzene, 4CH-015651, FT-0080591, FT-0601226, FT-0717922, W8514, MFCD00577359 (95%), A24050, B-5062, 1-bromo-2-((1s,4r)-4-pentylcyclohexyl)benzene, 12N-139, 4'-TRANS-N-PENTYLCYCLOHEXYL-4-BROMOBENZENE, 832B896, I14-6570, I14-6939, I14-9133, J-504437, TRANS-4-(4-PENTYLCYCLOHEXYL)-1-BROMOBENZENE, 1-BROMO-4-(TRANS-4-N-PENTYLCYCLOHEXYL)BENZENE(5CBB, 1-BROMO-4- BENZENE, CID3827903,

Complexity	210
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	308.114g/mol
Formal Charge	0
Heavy Atom Count	18
Hydrogen Bond Acceptor Count	0
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	309.291g/mol
Monoisotopic Mass	308.114g/mol
Rotatable Bond Count	5
Topological Polar Surface Area	0A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	7.6

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

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