AG00C6KP

33515-62-7 | SALOR-INT L164526-1EA

AG00C6KP

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CAS Number	33515-62-7
Catalog Number	AG00C6KP(AGN-PC-0LF7CK)
Chemical Name	SALOR-INT L164526-1EA
IUPAC Name	4-iodo-1H-pyrrole-2-carbaldehyde
InChI	InChI=1S/C5H4INO/c6-4-1-5(3-8)7-2-4/h1-3,7H
InChI Key	AEYJSULNKPFTAP-UHFFFAOYSA-N
MDL Number	MFCD03931537
Molecular Formula	C5H4INO
Molecular Weight	220.9958
SMILES	IC1=CNC(C=O)=C1
Synonyms	4-iodo-1H-pyrrole-2-carbaldehyde, 33515-62-7, 4-iodo-1H-Pyrrole-2-carboxaldehyde, 4-iodopyrrole-2-carboxaldehyde, 1H-Pyrrole-2-carboxaldehyde, 4-iodo-, AK-76715, AC1NGAQE, 4-iodo-pyrrole-2-carbaldehyde, SCHEMBL1126808, CTK8C4393, KS-00000IDC, DTXSID40405419, AEYJSULNKPFTAP-UHFFFAOYSA-N, CS-B1239, ZINC2519474, SALOR-INT L164526-1EA, ANW-71740, MFCD03931537, AKOS016007426, FCH1327646, MCULE-9362866105, RP05185, ACM33515627, AJ-37115, DS-16741, AX8167935, ST2405840, TC-160485, 4CH-017157, FT-0718455, Y8757, J-515541, C5H4INO, CID4671953,

Complexity	96.4
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	220.934g/mol
Formal Charge	0
Heavy Atom Count	8
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	220.997g/mol
Monoisotopic Mass	220.934g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	32.9A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number