AG00H02P

914349-52-3 | 2-(2-Aminopyrimidin-5-yl)benzaldehyde

AG00H02P

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CAS Number	914349-52-3
Catalog Number	AG00H02P(AGN-PC-07A1FV)
Chemical Name	2-(2-Aminopyrimidin-5-yl)benzaldehyde
IUPAC Name	2-(2-aminopyrimidin-5-yl)benzaldehyde
InChI	InChI=1S/C11H9N3O/c12-11-13-5-9(6-14-11)10-4-2-1-3-8(10)7-15/h1-7H,(H2,12,13,14)
InChI Key	YWJYEVPDHFSBMD-UHFFFAOYSA-N
MDL Number	MFCD05864832
Molecular Formula	C11H9N3O
Molecular Weight	199.2087
SMILES	O=CC1=CC=CC=C1C1=CN=C(N)N=C1
Synonyms	2-(2-Aminopyrimidin-5-yl)benzaldehyde, 914349-52-3, AK-17914, SCHEMBL2561391, CTK7I0000, KS-00000HKR, DTXSID90661700, ZINC2563846, ANW-52071, MFCD05864832, SBB092460, AKOS006229940, DS-0149, AJ-40940, BR-17914, AX8159487, DB-001980, TR-028800, FT-0712188, ST24027468, W9452, S-3245, BENZALDEHYDE,2-(2-AMINO-5-PYRIMIDINYL)-, 2-(2-aminopyrimidin-5-yl)benzaldehyde, AldrichCPR, C11H9N3O,

Complexity	214
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	199.075g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	199.213g/mol
Monoisotopic Mass	199.075g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	68.9A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.9

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number