AG00010V

100123-25-9 | 1H-Indole-2-carboxylic acid, 5-bromo-3-formyl-, ethyl ester

AG00010V

SDS

COA

Price

$0.00

Add to Cart

Buy Now

WARNING This product is not for human or veterinary use.

CAS Number	100123-25-9
Catalog Number	AG00010V(AGN-PC-0KRM5A)
Chemical Name	1H-Indole-2-carboxylic acid, 5-bromo-3-formyl-, ethyl ester
IUPAC Name	ethyl 5-bromo-3-formyl-1H-indole-2-carboxylate
InChI	InChI=1S/C12H10BrNO3/c1-2-17-12(16)11-9(6-15)8-5-7(13)3-4-10(8)14-11/h3-6,14H,2H2,1H3
InChI Key	VPJYMMSHBAEVOX-UHFFFAOYSA-N
MDL Number	MFCD02257704
Molecular Formula	C12H10BrNO3
Molecular Weight	296.1167
SMILES	O=C(C(N1)=C(C=O)C2=C1C=CC(Br)=C2)OCC
Synonyms	ethyl 5-bromo-3-formyl-1H-indole-2-carboxylate, 100123-25-9, 1H-Indole-2-carboxylicacid, 5-bromo-3-formyl-, ethyl ester, AC1MLU8B, ACMC-1BVT7, SCHEMBL333829, CTK3J8564, DTXSID00390933, VPJYMMSHBAEVOX-UHFFFAOYSA-N, IAE-0027, ZINC2578548, ZX-BK000551, 4097AJ, BBL020624, MFCD02257704, STK893314, AKOS001476163, AB11645, ACN-045371, MCULE-1417142829, AJ-42781, AK153548, SC-54719, AB0070788, AX8027098, DB-058300, ethyl 5-bromo-3-formylindole-2-carboxylate, BB 0249877, FT-0741216, ST24047088, Z-5183, 5-bromo-3-formyl-indole-2-carboxylic acid ethyl ester, 5-Bromo-3-formylindole-2-carboxylic acid ethyl ester, 1H-INDOLE-2-CARBOXYLIC ACID,5-BROMO-3-FORMYL-,ETHY, 3-Formyl-5-bromo-1H-indole-2-carboxylic acid ethyl ester, 5-Bromo-3-formyl-1H-indole-2-carboxylic acid ethyl ester, 1H-Indole-2-carboxylic acid, 5-bromo-3-formyl-, ethyl ester, C12H10BrNO3, ZINC02578548, CID3275613,

Complexity	310
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	294.984g/mol
Formal Charge	0
Heavy Atom Count	17
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	296.12g/mol
Monoisotopic Mass	294.984g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	59.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.8

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number