AG003L81

873-73-4 | 4-Chlorophenylacetylene

AG003L81

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CAS Number	873-73-4
Catalog Number	AG003L81(AGN-PC-0JL9HD)
Chemical Name	4-Chlorophenylacetylene
IUPAC Name	1-chloro-4-ethynylbenzene
InChI	InChI=1S/C8H5Cl/c1-2-7-3-5-8(9)6-4-7/h1,3-6H
InChI Key	LFZJRTMTKGYJRS-UHFFFAOYSA-N
MDL Number	MFCD00191917
Molecular Formula	C8H5Cl
Molecular Weight	136.5783
SMILES	ClC1=CC=C(C=C1)C#C
Synonyms	1-Chloro-4-ethynylbenzene, 873-73-4, 4-chlorophenylacetylene, Benzene, 1-chloro-4-ethynyl-, (4-Chlorophenyl)acetylene, 4'-Chlorophenyl acetylene, 1-chloro-4-ethynyl-benzene, p-chlorophenylacetylene, (p-Chlorophenyl)acetylene, MFCD00191917, LFZJRTMTKGYJRS-UHFFFAOYSA-N, 1-Chloro-4-ethynylbenzene, 98%, 1-chlor-4-ethinylbenzol, p-Ethynylchlorobenzene, 4-chloro-ethynylbenzene, chloro-4-ethynylbenzene, p-chlorophenyl-acetylene, 4-chlorophenyl acetylene, 4-chlorophenyl-acetylene, 1(4'-chlorophenyl)ethyne, 1-ethynyl-4-chlorobenzene, 4-chloro-1-ethynylbenzene, 1-chloro-4-phenylacetylene, 1-chlro 4-ethynyl benzene, AC1L2DE2, SCHEMBL166276, AC1Q284N, CTK3J1488, DTXSID90236275, ACN-S002662, ACN-S004503, ACT03274, ZINC1845607, ANW-38683, SBB064532, AKOS005146063, CS-W018322, PB21668, PS-5929, RP17327, RTC-061283, TRA0052213, AC-19414, AJ-31839, AN-47860, CJ-07131, CJ-30101, SC-21821, SY012961, AB0085505, AB1011661, TC-061283, TL8005670, FT-0618250, ST24037949, MFCD00191917 (98%), C-8832, 34644-EP2301536A1, 34644-EP2301538A1, 34644-EP2311455A1, 873C734, I01-5059, Q-102452, InChI=1/C8H5Cl/c1-2-7-3-5-8(9)6-4-7/h1,3-6, 4'-Chlorophenylacetylene, C8-H5-Cl, cc-138, 4-Chlorophenylacetylene, 98% 1g, CID70118, AR-1C2199, C2670, Benzene, 1-chloro-4-ethynyl- (6CI, 7CI, 8CI, 9CI), 93-54-9,

Complexity	123
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	136.008g/mol
Formal Charge	0
Heavy Atom Count	9
Hydrogen Bond Acceptor Count	0
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	136.578g/mol
Monoisotopic Mass	136.008g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	0A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	4.1
Hazard statements	H228-H315-H319-H335
Packing Group	Ⅱ
Precautionary statements	P210-P261-P305+P351+P338-P240-P241-P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313
UN Code	UN 1325

Certificate of Analysis

Lot Number