AG007RER

19493-44-8 | 1-Chloroisoquinoline

AG007RER

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CAS Number	19493-44-8
Catalog Number	AG007RER(AGN-PC-0JMRET)
Chemical Name	1-Chloroisoquinoline
IUPAC Name	1-chloroisoquinoline
InChI	InChI=1S/C9H6ClN/c10-9-8-4-2-1-3-7(8)5-6-11-9/h1-6H
InChI Key	MSQCQINLJMEVNJ-UHFFFAOYSA-N
MDL Number	MFCD00024134
Molecular Formula	C9H6ClN
Molecular Weight	163.6036
NSC Number	170839
SMILES	ClC1=NC=CC2=C1C=CC=C2
Synonyms	1-chloroisoquinoline, 19493-44-8, 1-Chloro-isoquinoline, Isoquinoline, 1-chloro-, chloroisoquinoline, 1-chloro isoquinoline, Isoquinoline, chloro-, MFCD00024134, 1-Chloroisoquinoline, 97+%, 1-Chloroisoquinone, NSC170839, zlchem 1129, PubChem13906, ACMC-1BOWU, AC1L3H6C, AC1Q3HX4, 1-Chloroisoquinoline, 95%, KSC179G9J, SCHEMBL144590, CTK0H9394, KS-00000FOB, DTXSID60173143, ZLD0597, MSQCQINLJMEVNJ-UHFFFAOYSA-N, ZINC388359, ACT01935, ALBB-023931, BCP08062, 19493-44-8 1-chloroisoquinoline, ANW-23666, BBL104227, SBB059626, STL558241, WT1334, AKOS003399220, AB01423, CC-1990, CM10596, CS-W002145, FS-2246, LS20934, MCULE-5866836026, NSC-170839, QC-8263, RP22647, RTX-010351, AC-23203, AJ-20575, AK-30305, BC212515, BP-10100, BR-30305, CJ-03222, SC-44075, SY008071, ZB011460, AB0031186, AB1009585, DB-019131, ST2408755, A4284, FT-0607648, ST45022775, X4181, MFCD00024134 (98%), S-1677, 92180-EP2299785A1, 92180-EP2306788A1, 92180-EP2306789A1, J-650287, Q-101894, F8885-1665, InChI=1/C9H6ClN/c10-9-8-4-2-1-3-7(8)5-6-11-9/h1-6, DL-3-Amino-n-butyric acid; 3-Aminobutyric acid; Aminobutyric acid,3-; BETA-Aminobutyric acid; H-DL-ABU(3)-OH; H-DL-ABU(BETA)-OH, Clc1nccc2ccccc12, C9H6ClN, * 1-CHLOROISOQUINOLINE, CID140539, 1-Chloroisoquinoline, 97% - 1G 1g, ACN-028424, C2097, C2609,

Complexity	138
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	163.019g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	163.604g/mol
Monoisotopic Mass	163.019g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	12.9A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard statements	H315-H319-H335
Precuationary statements	P261-P305+P351+P338
Siginal words

Certificate of Analysis

Lot Number