AG00C1YS

312263-48-2 | 2-isopropylpyrimidine-5-carbaldehyde

AG00C1YS

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CAS Number	312263-48-2
Catalog Number	AG00C1YS(AGN-PC-0KPZG0)
Chemical Name	2-isopropylpyrimidine-5-carbaldehyde
IUPAC Name	2-propan-2-ylpyrimidine-5-carbaldehyde
InChI	InChI=1S/C8H10N2O/c1-6(2)8-9-3-7(5-11)4-10-8/h3-6H,1-2H3
InChI Key	ZXPVVKXNLOGLGN-UHFFFAOYSA-N
MDL Number	MFCD07186436
Molecular Formula	C8H10N2O
Molecular Weight	150.1778
SMILES	C1(C(C)C)=NC=C(C=N1)C=O
Synonyms	312263-48-2, 2-Isopropylpyrimidine-5-carbaldehyde, 2-Isopropyl-pyrimidine-5-carbaldehyde, 2-ISOPROPYL-5-PYRIMIDINECARBALDEHYDE, AC1MKP3R, 2-(1-methylethyl)pyrimidine-5-carbaldehyde, SCHEMBL1134038, 5-Pyrimidinecarboxaldehyde, 2-(1-methylethyl)- (9CI), CTK7I0425, DTXSID90390285, ZXPVVKXNLOGLGN-UHFFFAOYSA-N, ZINC4487044, ANW-57711, MFCD07186436, AKOS000283858, AB30578, MCULE-3346881040, RTR-013290, 2-propan-2-ylpyrimidine-5-carbaldehyde, 2-(methylethyl)pyrimidine-5-carbaldehyde, AJ-51185, AS-41758, BAS 11212166, DA-19614, TR-013290, BB 0257592, FT-0677795, ST50291244, X5148, Y-2726, 2-(PROPAN-2-YL)PYRIMIDINE-5-CARBALDEHYDE, 2-isopropyl-pyrimidine-5-carbaldehyde, AldrichCPR, C8H10N2O, 1-methylazepane-2-carboxylic Acid, ZINC04487044, CID3160974,

Complexity	128
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	150.079g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	150.181g/mol
Monoisotopic Mass	150.079g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	42.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.8

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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