AG003O1V

7797-83-3 | Benzo[d][1,3]dioxole-4-carbaldehyde

AG003O1V

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CAS Number	7797-83-3
Catalog Number	AG003O1V(AGN-PC-0JLTS3)
Chemical Name	Benzo[d][1,3]dioxole-4-carbaldehyde
EC Number	232-252-4
IUPAC Name	1,3-benzodioxole-4-carbaldehyde
InChI	InChI=1S/C8H6O3/c9-4-6-2-1-3-7-8(6)11-5-10-7/h1-4H,5H2
InChI Key	QZMQKPGVXNSITP-UHFFFAOYSA-N
MDL Number	MFCD00016902
Molecular Formula	C8H6O3
Molecular Weight	150.1314
SMILES	O=CC1=C2OCOC2=CC=C1
Synonyms	7797-83-3, 1,3-benzodioxole-4-carbaldehyde, benzo[d][1,3]dioxole-4-carbaldehyde, 4-Formyl-1,3-benzodioxole, 2,3-(Methylenedioxy)benzaldehyde, 1,3-Benzodioxole-4-carboxaldehyde, 2H-1,3-benzodioxole-4-carbaldehyde, Benzo-1,3-dioxole-4-carboxaldehyde, 2,3-methylenedioxybenzaldehyde, Benzo[1,3]dioxole-4-carbaldehyde, EINECS 232-252-4, 184360-97-2, 2H-benzo[d]1,3-dioxolene-4-carbaldehyde, ACMC-209pcy, AC1Q6PSH, AC1Q6PVK, AC1Q6PVL, 2-methylenedioxybenzaldehyde, AC1Q6Q8N, 2,3-methylendioxybenzaldehyde, Integrase inhibitor, R2{1}, SCHEMBL161792, AC1L332J, 2,3-Methylenedioxy benzaldehyde, 2,3-methylenedioxy-benzaldehyde, 1,3-benzodioxole-4-carbaldehyd, BDBM93341, benzo[1,3]dioxole4-carbaldehyde, CTK0H4087, DTXSID90228635, QZMQKPGVXNSITP-UHFFFAOYSA-N, 2,3-(methylenedioxy)-benzaldehyde, benzo[1,3]dioxol-4-yl-methanone, ZINC158547, ANW-37136, MFCD00016902, SBB004074, STK301633, AKOS003791134, MCULE-7838832056, RP01639, RTR-037819, VZ20517, 2,3-(Methylenedioxy)benzaldehyde, 98%, AJ-15213, AK100000, AM806849, AN-16978, AS-19690, LS-34643, SC-65498, SY040440, ZB006928, AB0036864, ST2419132, TR-037819, CS-0043988, FT-0606549, FT-0649861, M1378, ST45061382, Y4079, EN300-42078, MFCD00016902 (97%), A13920, X-3823, 82937-EP2295439A1, 82937-EP2298758A1, 82937-EP2298759A1, 82937-EP2305664A1, J-503864, I14-10197, I14-39430, 3-Butenoic acid,4-(1,3-benzodioxol-4-yl)-, (3E)-, F1911-3808, 2,3- BENZALDEHYDE, C8H6O3, KST-1B8790, C8-H6-O3, CID82264, AR-1B6511, ZINC00158547, 82597-50-0,

Complexity	157
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	150.032g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	150.133g/mol
Monoisotopic Mass	150.032g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	35.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.2

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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