AG003CTV

6305-95-9 | 1-(2-Chlorophenyl)propan-2-one

AG003CTV

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CAS Number	6305-95-9
Catalog Number	AG003CTV(AGN-PC-0JO81M)
Chemical Name	1-(2-Chlorophenyl)propan-2-one
IUPAC Name	1-(2-chlorophenyl)propan-2-one
InChI	InChI=1S/C9H9ClO/c1-7(11)6-8-4-2-3-5-9(8)10/h2-5H,6H2,1H3
InChI Key	LWGNDIMNCPMZOF-UHFFFAOYSA-N
MDL Number	MFCD00045175
Molecular Formula	C9H9ClO
Molecular Weight	168.6202
NSC Number	22986
SMILES	CC(CC1=CC=CC=C1Cl)=O
Synonyms	1-(2-Chlorophenyl)propan-2-one, 6305-95-9, 2-chlorophenylacetone, 1-(2-Chlorophenyl)acetone, 1-(2-Chlorophenyl)-2-propanone, LWGNDIMNCPMZOF-UHFFFAOYSA-N, 2-Propanone, 1-(2-chlorophenyl)-, MFCD00045175, NSC22986, ACMC-20apcv, 2-chlorphenyl acetone, AC1Q3PEN, AC1L5H4M, SCHEMBL265672, 1-(2-Chlorophenyl)acetone #, KS-00000VDU, DTXSID70281768, 2-chlorophenylacetone, AldrichCPR, ZINC157126, STR06041, 1-(2-chloro-phenyl)-propan-2-one, NSC-22986, SBB054187, AKOS000215924, CM10944, LS11256, MCULE-3810531384, NE46796, AJ-14892, AK144117, SY037165, ZB006564, DB-054396, TC-172534, A8704, CS-0043797, FT-0605520, ST50406097, EN300-82845, MFCD00045175 (96%), 305C959, I01-9359, Q-102051, Z1695729091, KST-1B7755, AR-1B0701, CID229355, 2-Chlorophenylacetone, 98% - 1G 1g, 6968-42-9,

Complexity	145
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	168.034g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	168.62g/mol
Monoisotopic Mass	168.034g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	17.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.2

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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