AG003E3X

941-37-7 | 1-Bromo-3,5-dimethyladamantane

AG003E3X

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CAS Number	941-37-7
Catalog Number	AG003E3X(AGN-PC-07A1SF)
Chemical Name	1-Bromo-3,5-dimethyladamantane
EC Number	213-378-9
IUPAC Name	1-bromo-3,5-dimethyladamantane
InChI	InChI=1S/C12H19Br/c1-10-3-9-4-11(2,6-10)8-12(13,5-9)7-10/h9H,3-8H2,1-2H3
InChI Key	QUCXLVDIVQWYJR-UHFFFAOYSA-N
MDL Number	MFCD00077197
Molecular Formula	C12H19Br
Molecular Weight	243.1833
NSC Number	102293
SMILES	CC1(C2)CC3(C)CC2(Br)CC(C3)C1
Synonyms	1-Bromo-3,5-dimethyladamantane, 941-37-7, 1-bromo-3,5-dimethyl-adamantane, QUCXLVDIVQWYJR-UHFFFAOYSA-N, Tricyclo[3.3.1.13,7]decane, 1-bromo-3,5-dimethyl-, EINECS 213-378-9, NSC102293, ACMC-209rqd, MEMANTINE IMPURITY D, AC1Q25DH, AC1Q2QD0, 3,5-dimethyladamantylbromide, NCIOpen2_006758, SCHEMBL732916, 1-Bromo-3,5-dimethyltricyclo(3.3.1.13,7)decane, 1-bromo-3,5dimethyladamantane, AC1L402X, 3,5-dimethyl-1-bromoadamantane, CTK3I6639, 1-Bromo-3,5-Dimethyl adamantane, ACT10950, ALBB-013818, KS-00000GQ9, 1-bromanyl-3,5-dimethyl-adamantane, 1-?Bromo-?3,5-?dimethyladamantane, ANW-40211, STL453470, AKOS005174005, AC-5959, CB-2063, MCULE-6796620323, NSC-102293, RP28571, RTR-029456, TRA0045245, AK-93034, AN-10451, AS-14308, K714, SY042082, DB-019069, TR-029456, 4CH-007540, CS-0015436, FT-0633164, R1978, MFCD00077197 (98%), 222131A, A844841, I14-0561, I14-6729, 1-bromo-3,5-dimethyltricyclo[3.3.1.1~3,7~]decane, Tricyclo[3.3.1.1(3,7)-]decane, 1-bromo-3,5-dimethyl-, tricyclo[3.3.1.1~3,7~]decane, 1-bromo-3,5-dimethyl-, C12H19Br, C12-H19-Br, CID98317, AR-1C1964, B1821, 1-bromo-3,5-dimethyltricyclo[3.3.1.13,7]decane, Tricyclo(3.3.1.1(3,7)-)decane, 1-bromo-3,5-dimethyl-, 99745-62-7,

Complexity	240
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	242.067g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	0
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	243.188g/mol
Monoisotopic Mass	242.067g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	0A^2
Undefined Atom Stereocenter Count	2
Undefined Bond Stereocenter Count	0
XLogP3	5

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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