AG00E9OY

59669-59-9 | 3-tert-Butylisoxazol-5-amine

AG00E9OY

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CAS Number	59669-59-9
Catalog Number	AG00E9OY(AGN-PC-0KC1VB)
Chemical Name	3-tert-Butylisoxazol-5-amine
IUPAC Name	3-tert-butyl-1,2-oxazol-5-amine
InChI	InChI=1S/C7H12N2O/c1-7(2,3)5-4-6(8)10-9-5/h4H,8H2,1-3H3
InChI Key	APHNQOGPYLTSFX-UHFFFAOYSA-N
MDL Number	MFCD05266697
Molecular Formula	C7H12N2O
Molecular Weight	140.1830
SMILES	NC1=CC(C(C)(C)C)=NO1
Synonyms	59669-59-9, 3-tert-Butylisoxazol-5-amine, 3-(tert-Butyl)isoxazol-5-amine, 3-tert-butyl-1,2-oxazol-5-amine, 3-tert-Butyl-isoxazol-5-ylamine, 3-tert-Butylisoxazole-5-amine, 5-AMINO-3-TERT-BUTYLISOXAZOLE, 5-Isoxazolamine, 3-(1,1-dimethylethyl)-, MFCD05266697, 5-amino-3-t-butylisoxazole, 3-tert-Butylisoxazol-5-ylamine, PubChem15483, BAS 10320855, AC1M1GML, 3-t-butylisoxazol-5-amine, 3-t-butyl-5-aminoisoxazole, MLS000389001, 3-t-Butyl-5-amino isoxazole, SCHEMBL431491, 5-amino-3-(t-butyl)isoxazole, CHEMBL1904213, CTK5B0273, 5-amino-3-tert.-butyl-isoxazole, DTXSID60366513, APHNQOGPYLTSFX-UHFFFAOYSA-N, 3-(tert-Butyl);isoxazol-5-amine, HMS2545O09, 3-(tert-butyl)isoxazole-5-ylamine, BCP19280, KS-000002WW, ZINC2633232, BBL030357, CA-429, STL248271, 3-TERT-BUTYL-5-ISOXAZOLAMINE, AKOS000116865, MCULE-1910348529, PS-4070, RP01255, RP20621, 3-(1,1-dimethylethyl)-5-aminoisoxazole, 5-amino-3-(1,1-dimethylethyl)isoxazole, 5-Isoxazolamine,3-(1,1-dimethylethyl)-, AJ-44075, AK-28313, AN-39587, SC-50642, SMR000255175, AB0033543, DB-028040, TC-068440, 4CH-021305, BB 0218308, CS-0028753, FT-0646369, ST24041680, ST50290090, X7147, B80135, L-3426, I14-6403, J-513110, F2124-0434, C7H12N2O, 5-tert-butyl-1,2-oxazol-3-amine, ACN-032168, CID2095694, 3-tert-Butylisoxazol-5-amine, 97% - 1G 1g, A12430, 155213-67-5, 55809-36-4,

Complexity	119
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	140.095g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	140.186g/mol
Monoisotopic Mass	140.095g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	52A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code	\N

Certificate of Analysis

Lot Number