AG00HWKF

1427022-89-6 | 1-(Pyrimidin-2-yl)cyclopropanecarboxylic acid

AG00HWKF

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CAS Number	1427022-89-6
Catalog Number	AG00HWKF(AGN-PC-0WCXEX)
Chemical Name	1-(Pyrimidin-2-yl)cyclopropanecarboxylic acid
IUPAC Name	1-pyrimidin-2-ylcyclopropane-1-carboxylic acid
InChI	InChI=1S/C8H8N2O2/c11-7(12)8(2-3-8)6-9-4-1-5-10-6/h1,4-5H,2-3H2,(H,11,12)
InChI Key	OMNPYYRVZCQDLE-UHFFFAOYSA-N
MDL Number	MFCD22419321
Molecular Formula	C8H8N2O2
Molecular Weight	164.1613
SMILES	O=C(C1(C2=NC=CC=N2)CC1)O
Synonyms	1427022-89-6, 1-(pyrimidin-2-yl)cyclopropane-1-carboxylic acid, 1-(Pyrimidin-2-yl)cyclopropanecarboxylic acid, MFCD22419321, ZINC95094315, KS-000008U7, AS-51653, CS-0052796,

Complexity	195
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	164.059g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	164.164g/mol
Monoisotopic Mass	164.059g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	63.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0

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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