3-formyl-5-methyl-1H-indole-2-carboxylic acid

3-formyl-5-methyl-1H-indole-2-carboxylic acid

CAS: 842971-74-8

Formula: C11H9NO3

SMILES: CC1=CC=C2NC(C(O)=O)=C(C=O)C2=C1

IUPAC: 3-formyl-5-methyl-1H-indole-2-carboxylic acid

InChI: InChI=1S/C11H9NO3/c1-6-2-3-9-7(4-6)8(5-13)10(12-9)11(14)15/h2-5,12H,1H3,(H,14,15)

Composition: C (65.02%), H (4.46%), N (6.89%), O (23.62%)

Molar Mass: 203.197

Atom Count: 24

Heavy Atom Count: 15

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	203.058243154
Formal Charge	0
FSP3	0.09
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
InChIKey	BMVNZBKQRRYJSV-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	55.9
Topological Polar Surface Area	70.16
Polarizability	21.53
Ring Count	2
Rotatable Bond Count	2

Suppliers

OTAVA LTD.

Supplier Profile

Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<10 Days	842971-74-8		$208.21-$398.82$208.21$256.11$304.00$398.82

MFCD06800773

ChemBridge Corp.

Supplier Profile

Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<4 Days	842971-74-8		$105.80$105.80

MATRIX SCIENTIFIC

Supplier Profile

Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<2 Days	842971-74-8		$192.51$192.51