AG00IBY8

6953-22-6 | 5-Benzyloxy-3-formylindole

AG00IBY8

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CAS Number	6953-22-6
Catalog Number	AG00IBY8(AGN-PC-0JLT82)
Chemical Name	5-Benzyloxy-3-formylindole
EC Number	230-134-7
IUPAC Name	5-phenylmethoxy-1H-indole-3-carbaldehyde
InChI	InChI=1S/C16H13NO2/c18-10-13-9-17-16-7-6-14(8-15(13)16)19-11-12-4-2-1-3-5-12/h1-10,17H,11H2
InChI Key	DJGNUBADRQIDNQ-UHFFFAOYSA-N
MDL Number	MFCD00014562
Molecular Formula	C16H13NO2
Molecular Weight	251.2799
NSC Number	71049
SMILES	C2=C(OCC1=CC=CC=C1)C=CC3=C2C(=C[NH]3)C=O
Synonyms	6953-22-6, 5-Benzyloxyindole-3-carboxaldehyde, 5-Benzyloxyindole-3-carbaldehyde, 5-(Benzyloxy)-1H-indole-3-carbaldehyde, 5-benzyloxy-1h-indole-3-carbaldehyde, 5-(Phenylmethoxy)-1H-indole-3-carbaldehyde, 5-benzyloxy-3-formylindole, 5-Benzyloxy-indole-3-carboxaldehyde, 5-Benzyloxy-3-indolecarboxaldehyde, MFCD00014562, 1H-Indole-3-carboxaldehyde, 5-(phenylmethoxy)-, 5-Benzyloxy-3-formyl-1H-indole, DJGNUBADRQIDNQ-UHFFFAOYSA-N, 5-(Benzyloxy)indole-3-carbaldehyde, 5-benzyloxy indole-3-carboxyaldehyde, AK-16424, B-1870, 5-(phenylmethoxy)indole-3-carbaldehyde, NSC71049, EINECS 230-134-7, PubChem7317, AC1Q6PY2, AC1Q6QG7, 5-Benzyloxyindol-3-aldehyde, KSC495A6B, MLS001360008, ACMC-209o95, SCHEMBL1791105, CHEMBL1592937, CTK3J5060, DTXSID90219785, HMS3052E22, 5-benzyloxy indole-3-carboxaldehyde, AC1L3190, ACN-S002837, ACT03566, BB_SC-10800, KS-00000B2V, ZINC1696613, ZX-AT007829, 5-Benzyl-Oxy-3-Indolecarboxaldehyde, 5-BENZYLOXYINDOLE-3-ALDEHYDE, ANW-35703, BBL027808, CB-200, NSC-71049, OR1344, SBB005316, STK935208, 5-(benzyloxy)-3-indolecarboxyaldehyde, AKOS005207077, AB01159, AN-5520, AS06610, COR0003215, CS-W014096, DS-0066, MCULE-4739911668, PS-7463, RP28956, RTC-060658, TRA0077299, VI30260, NCGC00247293-01, 5-Benzyloxyindole-3-carboxaldehyde, 98%, 5-phenylmethoxy-1H-indole-3-carbaldehyde, AC-18163, AC-24616, AJ-30312, BR-16424, CC-21220, CJ-06599, CJ-28469, SMR001224347, ST080599, SY026618, 5-(benzyloxy)-1h-indole-3-carboxaldehyde, 5-Benzyloxyindole-3-carboxaldehyde, powder, 5-(Benzyloxy)-1H-indole-3-carbaldehyde #, AB0007258, AX8008712, DB-031759, ST2418618, TC-060658, A9195, AM20060948, FT-0620054, MFCD00014562 (97%), M-1588, 953B226, B194581, C-15498, I01-2840, 5-Methoxyindole-3-carboxaldehyde, C16H13NO2, CID81398, AR-1G7316, C16-H13-N-O2, 5-Benzyloxyindole-3-carboxaldehyde, 98% - 1G 1g, 10601-19-1, 7151-49-7,

Complexity	301
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	251.095g/mol
Formal Charge	0
Heavy Atom Count	19
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	251.285g/mol
Monoisotopic Mass	251.095g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	42.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H317-H319
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

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