AG003O1T

14268-66-7 | 1,3-dioxaindan-5-amine

AG003O1T

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CAS Number	14268-66-7
Catalog Number	AG003O1T(AGN-PC-086DQS)
Chemical Name	1,3-dioxaindan-5-amine
EC Number	238-161-6
IUPAC Name	1,3-benzodioxol-5-amine
InChI	InChI=1S/C7H7NO2/c8-5-1-2-6-7(3-5)10-4-9-6/h1-3H,4,8H2
InChI Key	XGNXYCFREOZBOL-UHFFFAOYSA-N
MDL Number	MFCD00005832
Molecular Formula	C7H7NO2
Molecular Weight	137.1360
NSC Number	155176
SMILES	Nc1ccc2c(c1)OCO2
UNII	2Q750587K8
Synonyms	14268-66-7, 3,4-(Methylenedioxy)aniline, 1,3-Benzodioxol-5-amine, Benzo[d][1,3]dioxol-5-amine, 5-Amino-1,3-benzodioxole, 3,4-Methylenedioxyaniline, 4-Amino-1,2-methylenedioxybenzene, 5-Aminobenzodioxole, Methylenedioxyaniline, 2H-1,3-Benzodioxol-5-Amine, 1-Amino-3,4-methylenedioxybenzene, 1-Amino-3,4-dimethylenedioxybenzene, MFCD00005832, Aniline, 3,4-(methylenedioxy)-, UNII-2Q750587K8, NSC 155176, XGNXYCFREOZBOL-UHFFFAOYSA-N, 3,4-(Methylenedioxy)aniline, 97%, 4-methylenedioxyaniline, (BENZO[1,3]DIOXOL-5-YL)AMINE, 2Q750587K8, Benzo[1,3]dioxol-5-ylamine, EINECS 238-161-6, NSC155176, PubChem22150, 3,4-methylendioxyaniline, AC1Q6ZYM, ACMC-1C1IJ, 3,4-methylendioxy aniline, 3,4-methylendioxy-aniline, 3,4-methylenedioxy aniline, 3,4-methylenedioxy-aniline, AC1Q52FX, 1,3-benzodioxol-5-ylamine, 3,4-(methylendioxy)aniline, 3,4-methylenedioxyphenylamine, Aniline,4-(methylenedioxy)-, 3,4-(methylendioxy)-aniline, SCHEMBL126245, 3,4-(methylenedioxy) aniline, 3,4-(Methylenedioxy)-aniline, AC1L377D, Benzo[1,3] dioxol-5-ylamine, DTXSID8065743, CTK0H5726, benzo[d][1,3]dioxol-5-ylamine, ZINC164370, KS-00000LN5, STR00825, ANW-20716, BBL010077, SBB028254, STK801439, 1,2-(Methylenedioxy)-4-aminobenzene, 2H-benzo[d]1,3-dioxolane-5-ylamine, 2H-benzo[d]1,3-dioxolene-5-ylamine, AKOS000269043, ACN-043286, AS06260, CS-W001111, MCULE-4838589183, NSC-155176, PS-4564, SDCCGMLS-0066217.P001, TRA0051848, AC-10835, AJ-16123, CJ-02116, L411, SC-22390, ZB008112, AB1003351, DB-042641, RT-002155, ST2419129, M0741, ST50214363, B-7242, 65304-EP2281563A1, 65304-EP2286812A1, 65304-EP2308812A2, 151087-EP2289887A2, 151087-EP2289888A2, 268M667, I01-3157, W-108175, F2190-0469, InChI=1/C7H7NO2/c8-5-1-2-6-7(3-5)10-4-9-6/h1-3H,4,8H, Nc1ccc2OCOc2c1, C7H7NO2, 3, 4- (methylenedioxy)aniline, 2-Amino-3,5-dimethylbenzoic acid, C7-H7-N-O2, KST-1B0494, CID84310, AR-1B6476, A15234, 14438-32-5,

Complexity	129
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	137.048g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	137.138g/mol
Monoisotopic Mass	137.048g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	44.5A^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-H312-H315-H319-H331
Packing Group
Precautionary statements	P261-P280-P304+P340-P305+P351+P338-P405-P501a
UN Code

Certificate of Analysis

Lot Number