AG003EVR

80854-14-4 | 2-(4-Chlorophenyl)-2-methylpropan-1-ol

AG003EVR

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CAS Number	80854-14-4
Catalog Number	AG003EVR(AGN-PC-0UI0NL)
Chemical Name	2-(4-Chlorophenyl)-2-methylpropan-1-ol
IUPAC Name	2-(4-chlorophenyl)-2-methylpropan-1-ol
InChI	InChI=1S/C10H13ClO/c1-10(2,7-12)8-3-5-9(11)6-4-8/h3-6,12H,7H2,1-2H3
InChI Key	NJTICDHSNUXDFF-UHFFFAOYSA-N
MDL Number	MFCD06657569
Molecular Formula	C10H13ClO
Molecular Weight	184.6626
SMILES	ClC1=CC=C(C=C1)C(CO)(C)C
Synonyms	80854-14-4, 2-(4-Chlorophenyl)-2-methylpropan-1-ol, 2-(4-Chlorophenyl)-2-methylpropanol, ACMC-1BMGQ, SCHEMBL1807039, CTK5E8241, DTXSID40515946, NJTICDHSNUXDFF-UHFFFAOYSA-N, 2-(4-Chlrophenyl)-2-methylpropanol, 2572AC, ANW-37398, MFCD06657569, ZINC21985860, 2-methyl-2-(4-chlorophenyl)propanol, AKOS015889845, Benzeneethanol,4-chloro-b,b-dimethyl-, FCH1122752, AJ-79411, SC-58198, 2-(4-chlorophenyl)-2-methyl-propan-1-ol, 2-(4-chlorophenyl)-2-methylpropyl alcohol, AX8062191, TC-126143, FT-0689888, KS-00001445, I01-3652, I01-7069, 2- -2-methylpropanol, C10H13ClO, C2176,

Complexity	137
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	184.065g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	184.663g/mol
Monoisotopic Mass	184.065g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	20.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319
Packing Group
Precautionary statements	P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313
UN Code

Certificate of Analysis

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