AG003B1G

104-52-9 | (3-Chloropropyl)benzene

AG003B1G

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CAS Number	104-52-9
Catalog Number	AG003B1G(AGN-PC-0JK87W)
Chemical Name	(3-Chloropropyl)benzene
EC Number	203-210-2
IUPAC Name	3-chloropropylbenzene
InChI	InChI=1S/C9H11Cl/c10-8-4-7-9-5-2-1-3-6-9/h1-3,5-6H,4,7-8H2
InChI Key	XZBXAYCCBFTQHH-UHFFFAOYSA-N
MDL Number	MFCD00001001
Molecular Formula	C9H11Cl
Molecular Weight	154.6366
NSC Number	16939
SMILES	ClCCCC1=CC=CC=C1
Synonyms	1-Chloro-3-phenylpropane, (3-CHLOROPROPYL)BENZENE, 104-52-9, 3-Phenylpropyl chloride, Benzene, (3-chloropropyl)-, 3-chloropropylbenzene, 3-Chloro-1-phenylpropane, 3-Phenyl-1-chloropropane, .gamma.-Chloropropylbenzene, 4-chloropropylbenzene, Benzene, (chloropropyl)-, .gamma.-Phenylpropyl chloride, XZBXAYCCBFTQHH-UHFFFAOYSA-N, MFCD00001001, EINECS 203-210-2, 3-penylpropylchloride, gamma-Chloropropylbenzene, AI3-23863, AC1Q3ULD, 3-(phenyl)propyl chloride, gamma-Phenylpropyl chloride, (3-chloro-propyl)-benzene, AC1L1PD6, AC1Q3UL5, Alverine Citrate Impurity A, ACMC-1AZ96, (3-Chloro-1-propyl)benzene, SCHEMBL432616, CTK3J2848, XZBXAYCCBFTQHH-UHFFFAOYSA-, DTXSID10146206, 1-Chloro-3-phenylpropane, 99%, KS-00000WY2, NSC16939, ZINC1747835, ANW-15079, NSC 16939, NSC-16939, SBB061361, STL268874, AKOS000121307, GS-3136, MCULE-8754274548, RP21913, RTR-018747, TRA0070389, AJ-31439, I120, SY048978, DB-027396, DB-052221, TR-018747, FT-0616350, P1262, ST24034365, ST51047383, MFCD00001001 (97%), C-5803, I01-3008, W-109386, I01-14427, F0001-0090, InChI=1/C9H11Cl/c10-8-4-7-9-5-2-1-3-6-9/h1-3,5-6H,4,7-8H2, LT1, Hydrocinnamyl chloride, p-Chloropropylbenzene, (3-chlorpropyl)benzen, 3-Phenylpropanyl chloride, C9H11Cl, C9-H11-Cl, CID7706, KST-1A0442, AR-1A4151, 3-Phenylpropyl chloride, 99% - 100G 100g, 52944-34-0, 105072-16-0,

Complexity	74.8
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	154.055g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	0
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	154.637g/mol
Monoisotopic Mass	154.055g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	0A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.5

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

Lot Number