AG0033G6

6398-87-4 | 3-(1,3-Dioxolan-2-yl)aniline

AG0033G6

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CAS Number	6398-87-4
Catalog Number	AG0033G6(AGN-PC-0LW8ZT)
Chemical Name	3-(1,3-Dioxolan-2-yl)aniline
IUPAC Name	3-(1,3-dioxolan-2-yl)aniline
InChI	InChI=1S/C9H11NO2/c10-8-3-1-2-7(6-8)9-11-4-5-12-9/h1-3,6,9H,4-5,10H2
InChI Key	SPLTWZBWXIJQME-UHFFFAOYSA-N
MDL Number	MFCD00272236
Molecular Formula	C9H11NO2
Molecular Weight	165.1891
SMILES	O1C(OCC1)C=1C=C(N)C=CC1
Synonyms	3-(1,3-dioxolan-2-yl)aniline, 6398-87-4, 3-AMINOBENZALDEHYDE ETHYLENE ACETAL, 2-(3-aminophenyl)-1,3-dioxolan, Benzenamine, 3-(1,3-dioxolan-2-yl)-, 3-(1,3-dioxolan-2-yl)phenylamine, 3-[1,3]Dioxolan-2-yl-phenylamine, zlchem 897, AC1ODSYB, ACMC-1B47K, SCHEMBL233910, CTK7D8874, DTXSID50427243, ZLD0359, SPLTWZBWXIJQME-UHFFFAOYSA-N, 3-(1,3-Dioxolane-2-yl)aniline, ACT05736, ALBB-023363, ZINC2563675, 7247AE, MFCD00272236, SBB051785, AKOS003375680, [3-(1,3-dioxolan-2-yl)phenyl]amine, AB05573, MCULE-4991875032, TRA0074060, VZ26329, AS-31239, CJ-09621, AB0062288, AB1000662, TC-170277, FT-0636131, R2779, ST45026597, 3-Aminobenzaldehyde ethylene acetal, AldrichCPR, M-AMINOBENZALDEHYDE ETHYLENE GLYCOL ACETAL, A834602, null, 3- ANILINE, C9H11NO2, ZINC02563675, ACN-025879, CID7020362,

Complexity	146
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	165.079g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	165.192g/mol
Monoisotopic Mass	165.079g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	44.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.6

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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