AG0033CX

915140-06-6 | 2-Hydroxymethyl-isonicotinicacid

AG0033CX

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CAS Number	915140-06-6
Catalog Number	AG0033CX(AGN-PC-03FWEI)
Chemical Name	2-Hydroxymethyl-isonicotinicacid
IUPAC Name	2-(hydroxymethyl)pyridine-4-carboxylic acid
InChI	InChI=1S/C7H7NO3/c9-4-6-3-5(7(10)11)1-2-8-6/h1-3,9H,4H2,(H,10,11)
InChI Key	HMFKOGCATGREDJ-UHFFFAOYSA-N
MDL Number	MFCD11977439
Molecular Formula	C7H7NO3
Molecular Weight	153.1354
SMILES	OCc1nccc(c1)C(=O)O
Synonyms	2-(Hydroxymethyl)isonicotinic acid, 915140-06-6, 2-(HYDROXYMETHYL)PYRIDINE-4-CARBOXYLIC ACID, 2-Hydroxymethyl-isonicotinicacid, 2-(hydroxymethyl)-4-pyridinecarboxylic acid, 2-Hydroxymethyl-isonicotinic acid, 4-Pyridinecarboxylic acid, 2-(hydroxymethyl)-, ACMC-20aexm, PYHM62, SCHEMBL2305108, CTK3I5730, DTXSID70618257, KS-000000DC, 5377AC, ANW-70280, MFCD11977439, ZINC67172211, AKOS016002626, FCH1152918, RP01786, AK100397, AJ-116807, AX8241348, DB-031368, TC-060091, 4CH-012188, FT-0717799, ST24021881, Y9548, 4-Pyridinecarboxylicacid, 2-(hydroxymethyl)-, A843953, J-506441, C7H7NO3, 4-PYRIDINECARBOXYLIC ACID, 2-(HYDROXYMETHYL), 58481-17-7,

Complexity	149
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	153.043g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	153.137g/mol
Monoisotopic Mass	153.043g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	70.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-0.5

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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