AG00DF6J

50773-56-3 | 3-Benzyloxy-4-hydroxybenzaldehyde

AG00DF6J

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CAS Number	50773-56-3
Catalog Number	AG00DF6J(AGN-PC-0NEK4H)
Chemical Name	3-Benzyloxy-4-hydroxybenzaldehyde
IUPAC Name	4-hydroxy-3-phenylmethoxybenzaldehyde
InChI	InChI=1S/C14H12O3/c15-9-12-6-7-13(16)14(8-12)17-10-11-4-2-1-3-5-11/h1-9,16H,10H2
InChI Key	CWMRCRFALIQFHU-UHFFFAOYSA-N
MDL Number	MFCD09836534
Molecular Formula	C14H12O3
Molecular Weight	228.2433
SMILES	O=CC1=CC=C(O)C(OCC2=CC=CC=C2)=C1
Synonyms	3-(benzyloxy)-4-hydroxybenzaldehyde, 50773-56-3, 3-benzyloxy-4-hydroxybenzaldehyde, 4-Hydroxy 3-(phenylmethoxy)benzaldehyde, Benzaldehyde, 4-hydroxy-3-(phenylmethoxy)-, SCHEMBL1031969, 3-benzyloxy-4-hydroxybenzaldeyde, CTK1G6084, DTXSID10452197, 3-bezyloxy-4-hydroxy benzaldehyde, CWMRCRFALIQFHU-UHFFFAOYSA-N, 3-Benzyloxy-4-hydroxy benzaldehyde, 4-hydroxy-3-phenylmethoxybenzaldehyde, MFCD09836534, ZINC73734136, AKOS005067842, FCH2825486, OR70176, 4-hydroxy-3-(phenylmethoxy)benzaldehyde, KS-0000054B, AK173841, AS-52566, CS-0051717, 4-hydroxy-3-phenylmethoxy-benzaldehyde, CID11020635,

Complexity	236
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	228.079g/mol
Formal Charge	0
Heavy Atom Count	17
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	228.247g/mol
Monoisotopic Mass	228.079g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	46.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H319-H412
Packing Group
Precautionary statements	P273-P305+P351+P338
UN Code

Certificate of Analysis

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