AG003JS7

446866-87-1 | 3-Morpholinobenzaldehyde

AG003JS7

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CAS Number	446866-87-1
Catalog Number	AG003JS7(AGN-PC-0LX683)
Chemical Name	3-Morpholinobenzaldehyde
IUPAC Name	3-morpholin-4-ylbenzaldehyde
InChI	InChI=1S/C11H13NO2/c13-9-10-2-1-3-11(8-10)12-4-6-14-7-5-12/h1-3,8-9H,4-7H2
InChI Key	LQORKFSMUOSSQM-UHFFFAOYSA-N
MDL Number	MFCD07772811
Molecular Formula	C11H13NO2
Molecular Weight	191.2264
SMILES	O=CC1=CC(=CC=C1)N1CCOCC1
Synonyms	3-morpholinobenzaldehyde, 446866-87-1, 3-morpholin-4-ylbenzaldehyde, 4-(3-Formylphenyl)morpholine, 3-(4-morpholinyl)benzaldehyde, 3-morpholin-4-yl-benzaldehyde, 3-(Morpholin-4-yl)benzaldehyde, PubChem13334, AC1OGC1X, 3-(Morpholin-4-yl)benzaldehyd, SCHEMBL1443605, CTK4I8405, KS-00000AYL, DTXSID80428182, Benzaldehyde,3-(4-morpholinyl)-, LQORKFSMUOSSQM-UHFFFAOYSA-N, ACT05589, ZINC4277351, ANW-58642, CM-999, MFCD07772811, SBB091291, AKOS002391968, AC-2799, CM-2269, RP03781, RTC-030427, TRA0047484, VZ27125, AJ-50099, AN-13608, BC683669, CJ-11813, CS-11021, SC-23129, SY002950, AB0041388, DB-006502, ST2405156, TC-030427, 4CH-004277, FT-0601644, Y9136, K-8983, MFCD07772811 (97+%), 866M871, A826666, J-512942, I14-17455, C11H13NO2, ZINC04277351, CID7164584,

Complexity	190
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	191.095g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	191.23g/mol
Monoisotopic Mass	191.095g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	29.5A^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+H312-H315-H319-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number