1,4-di-tert-butyl (2Z)-but-2-enedioate

1,4-di-tert-butyl (2Z)-but-2-enedioate

CAS: 18305-60-7

Formula: C12H20O4

SMILES: CC(C)(C)OC(=O)C=C/C(=O)OC(C)(C)C

IUPAC: 1,4-di-tert-butyl (2Z)-but-2-enedioate

InChI: InChI=1S/C12H20O4/c1-11(2,3)15-9(13)7-8-10(14)16-12(4,5)6/h7-8H,1-6H3/b8-7-

Composition: C (63.14%), H (8.83%), O (28.03%)

Molar Mass: 228.288

Atom Count: 36

Heavy Atom Count: 16

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	0
Exact Mass	228.136159124
Formal Charge	0
FSP3	0.67
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	MSVGHYYKWDQHFV-FPLPWBNLSA-N
Lipinski's Rule of Five	1
Molar Refractivity	61.76
Topological Polar Surface Area	52.6
Polarizability	24.14
Ring Count	0
Rotatable Bond Count	6

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