AG0012MT

1369851-30-8 | Benzoic acid, 3,4-bis(cyclopropylMethoxy)-

AG0012MT

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CAS Number	1369851-30-8
Catalog Number	AG0012MT(AGN-PC-0WAMEN)
Chemical Name	Benzoic acid, 3,4-bis(cyclopropylMethoxy)-
IUPAC Name	3,4-bis(cyclopropylmethoxy)benzoic acid
InChI	InChI=1S/C15H18O4/c16-15(17)12-5-6-13(18-8-10-1-2-10)14(7-12)19-9-11-3-4-11/h5-7,10-11H,1-4,8-9H2,(H,16,17)
InChI Key	FMGSFZUGHYOLAL-UHFFFAOYSA-N
MDL Number	MFCD28016548
Molecular Formula	C15H18O4
Molecular Weight	262.3010
SMILES	O=C(O)C1=CC=C(OCC2CC2)C(OCC3CC3)=C1
Synonyms	3,4-Bis(cyclopropylmethoxy)benzoic acid, 1369851-30-8, AK187842, Benzoic acid, 3,4-bis(cyclopropylMethoxy)-, MFCD28016548, AKOS025404445, ZINC253496106, DS-9825, AC-28928,

Complexity	322
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	262.121g/mol
Formal Charge	0
Heavy Atom Count	19
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	262.305g/mol
Monoisotopic Mass	262.121g/mol
Rotatable Bond Count	7
Topological Polar Surface Area	55.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.1

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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