AG003O4N

72594-86-6 | BENZYL TERT-BUTYL MALONATE

AG003O4N

SDS

COA

Price

$0.00

Add to Cart

Buy Now

WARNING This product is not for human or veterinary use.

CAS Number	72594-86-6
Catalog Number	AG003O4N(AGN-PC-0KK80O)
Chemical Name	BENZYL TERT-BUTYL MALONATE
IUPAC Name	1-O-benzyl 3-O-tert-butyl propanedioate
InChI	InChI=1S/C14H18O4/c1-14(2,3)18-13(16)9-12(15)17-10-11-7-5-4-6-8-11/h4-8H,9-10H2,1-3H3
InChI Key	XKXXXODAXXAFNP-UHFFFAOYSA-N
MDL Number	MFCD01075175
Molecular Formula	C14H18O4
Molecular Weight	250.2903
SMILES	O=C(OC(C)(C)C)CC(OCC1=CC=CC=C1)=O
Synonyms	BENZYL TERT-BUTYL MALONATE, 72594-86-6, Benzyltert-butylmalonate, tert-Butyl benzyl malonate, MFCD01075175, tert-butyl 2-(benzyloxycarbonyl)acetate, AK111121, 1-BENZYL 3-TERT-BUTYL PROPANEDIOATE, Propanedioic acid, 1,1-dimethylethyl phenylmethyl ester, 16881-32-6, tert-butyl phenylmethyl propane-1,3-dioate, PubChem3938, t-butyl benzyl malonate, AC1MC66U, KSC493Q0N, SCHEMBL394244, CTK3J3806, KS-00000BNP, DTXSID60371546, XKXXXODAXXAFNP-UHFFFAOYSA-N, EBD12400, ZINC2572548, ZX-AT007196, Malonic acid benzyl tert-butyl ester, KM1490, OR4154, SBB068291, benzyl 2-(tert-butoxycarbonyl)acetate, AKOS015915482, Benzyl tert-butyl propane-1,3-dioate, Benzyl-2-(tert-butoxycarbonyl)-acetate, MCULE-9976387698, PS-5065, RP06117, TRA0085386, 1-O-benzyl 3-O-tert-butyl propanedioate, AJ-42037, CC-24497, CJ-09962, DA-43555, Malonic acid 1-tert-butyl 3-benzyl ester, SY019190, AB0042070, AX8015538, RT-001722, FT-0080922, FT-0622830, ST24030160, ST50408225, Y9923, MFCD01075175 (95+%), C-15422, I14-5872, J-524776, C14H18O4, ZINC02572548, CID2736712, 54244-69-8,

Complexity	285
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	250.121g/mol
Formal Charge	0
Heavy Atom Count	18
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	250.294g/mol
Monoisotopic Mass	250.121g/mol
Rotatable Bond Count	7
Topological Polar Surface Area	52.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.6

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number