AG003CBC

98167-06-7 | (R)-Indoline-2-carboxylic acid

AG003CBC

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CAS Number	98167-06-7
Catalog Number	AG003CBC(AGN-PC-0OOTYC)
Chemical Name	(R)-Indoline-2-carboxylic acid
IUPAC Name	(2R)-2,3-dihydro-1H-indole-2-carboxylic acid
InChI	InChI=1S/C9H9NO2/c11-9(12)8-5-6-3-1-2-4-7(6)10-8/h1-4,8,10H,5H2,(H,11,12)/t8-/m1/s1
InChI Key	QNRXNRGSOJZINA-MRVPVSSYSA-N
MDL Number	MFCD00792496
Molecular Formula	C9H9NO2
Molecular Weight	163.1733
SMILES	O=C([C@@H]1NC2=C(C=CC=C2)C1)O
Synonyms	(R)-Indoline-2-carboxylic Acid, 98167-06-7, (R)-(+)-Indoline-2-carboxylic acid, (2R)-2,3-dihydro-1H-indole-2-carboxylic acid, (R)-(-)-Indoline-2-carboxylic acid, (2R)-indoline-2-carboxylic acid, MFCD00792496, h-idc-oh, (R)-(+)-2,3-Dihydroindole-2-carboxylic acid, (R)-2,3-Dihydro-1H-indole-2-carboxylic acid, 1H-Indole-2-carboxylic acid, 2,3-dihydro-, (2R)-, R-(+)-Indoline-2-carboxylic acid, PubChem20604, AC1OBW7O, Oprea1_181429, KSC486M0L, SCHEMBL1134239, CTK3I6605, QNRXNRGSOJZINA-MRVPVSSYSA-, QNRXNRGSOJZINA-MRVPVSSYSA-N, (r)-1h-indole-2-carboxylic acid, ZINC133575, ACN-S002907, ACT02499, ANW-40909, CI-070, AKOS005259556, AC-1319, FCH1121449, OC-0229, RTR-030294, KS-000002C2, KS-000005K3, AJ-12193, AK-76489, AN-15076, AS-31788, BC210954, CC-01164, N945, OR316047, AB0016154, AB1001732, AX8007780, DB-002987, ST2414490, TR-030294, FT-0642359, I0589, D57199, M-2974, (R)-(+)-Indoline-2-carboxylic acid, >=97.0%, 815I206, C-04339, InChI=1/C9H9NO2/c11-9(12)8-5-6-3-1-2-4-7(6)10-8/h1-4,8,10H,5H2,(H,11,12)/t8-/m1/s1, C9H9NO2, 1H-Indole-2-carboxylic acid, (S)-(-)-Indoline-2-carboxylic acid, ACN-039995, CID6928266, CDS1_000178, 2,3-dihydro-1H-indole-2-carboxylic acid, A15943, (R)-( )-Indoline-2-carboxylic acid, 97% - 1G 1g, 1H-Indole-2-carboxylic acid, 2,3-dihydro-, (2R)- (9CI), 79815-20-6, 6-fluoro-1-(4-fluorophenyl)-7-(4-methylpiperazin-1-yl)-4-oxoquinoline-3-carboxylic acid, 55453-87-7, ICB,

Complexity	193
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	163.063g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	163.176g/mol
Monoisotopic Mass	163.063g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	49.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.6

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H317-H361-H373
Packing Group
Precautionary statements	P262-P280h-P305+P351+P338-P280-P201-P202-P261-P272-P302+P352+P333+P313+P363-P308+P313-P405-P501
UN Code

Certificate of Analysis

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