AG00EFVD

63762-72-1 | 1H-Indole, 6-chloro-5-Methoxy-

AG00EFVD

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CAS Number	63762-72-1
Catalog Number	AG00EFVD(AGN-PC-00KYBL)
Chemical Name	1H-Indole, 6-chloro-5-Methoxy-
IUPAC Name	6-chloro-5-methoxy-1H-indole
InChI	InChI=1S/C9H8ClNO/c1-12-9-4-6-2-3-11-8(6)5-7(9)10/h2-5,11H,1H3
InChI Key	SSBPRGFEADRKDA-UHFFFAOYSA-N
MDL Number	MFCD11848567
Molecular Formula	C9H8ClNO
Molecular Weight	181.6189
SMILES	COC1=CC2=C(NC=C2)C=C1Cl
Synonyms	6-CHLORO-5-METHOXY-1H-INDOLE, 63762-72-1, 6-chloro-5-methoxyindole, 5-methoxy-6-chloro-1H-indole, SCHEMBL7866316, KS-00000QXT, DTXSID70518804, SSBPRGFEADRKDA-UHFFFAOYSA-N, 1H-Indole, 6-chloro-5-methoxy-, MFCD11848567, ZINC37625159, AKOS016846033, DS-5251, QC-9732, SB14722, AJ-94171, AK111540, SC-22317, AB0072397, DB-073391, CS-0036414, FT-0729333, W-2932, Z2050688001,

Complexity	165
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	181.029g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	181.619g/mol
Monoisotopic Mass	181.029g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	25A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.6

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H317
Packing Group
Precautionary statements	P280
UN Code

Certificate of Analysis

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