tert-butylbenzene;2-tert-butyl-5-chlorothiophene;6-tert-butyl-2,3-dihydro-1,4-benzodioxine;5-tert-butyl-2,3-dihydro-1-benzofuran;4-tert-butyl-3,5-dimethyl-1,2-oxazole;5-tert-butyl-N,N-dimethylpyrimidin-2-amine;3-tert-butylfuran;1-tert-butyl-2-methoxybenzene;1-tert-butyl-3-methoxybenzene;1-tert-butyl-4-methoxybenzene;1-tert-butyl-4-(methoxymethyl)benzene;5-tert-butyl-2-methoxypyrimidine;4-tert-butyl-1-methylpyrazole;5-tert-butyl-1-methylpyrazole;1-tert-butyl-4-phenylbenzene;1-[(4-tert-butylphenyl)methyl]piperidine;5-tert-butyl-1H-pyrazole;4-tert-butylpyridine;2-tert-butylthiophene;3-tert-butylthiophene;[(E)-3,3-dimethylbut-1-enyl]benzene

C215H317ClN14O10S3 — CID 159675893

IUPACtert-butylbenzene;2-tert-butyl-5-chlorothiophene;6-tert-butyl-2,3-dihydro-1,4-benzodioxine;5-tert-butyl-2,3-dihydro-1-benzofuran;4-tert-butyl-3,5-dimethyl-1,2-oxazole;5-tert-butyl-N,N-dimethylpyrimidin-2-amine;3-tert-butylfuran;1-tert-butyl-2-methoxybenzene;1-tert-butyl-3-methoxybenzene;1-tert-butyl-4-methoxybenzene;1-tert-butyl-4-(methoxymethyl)benzene;5-tert-butyl-2-methoxypyrimidine;4-tert-butyl-1-methylpyrazole;5-tert-butyl-1-methylpyrazole;1-tert-butyl-4-phenylbenzene;1-[(4-tert-butylphenyl)methyl]piperidine;5-tert-butyl-1H-pyrazole;4-tert-butylpyridine;2-tert-butylthiophene;3-tert-butylthiophene;[(E)-3,3-dimethylbut-1-enyl]benzene
SMILESCC(C)(C)/C=C/c1ccccc1.CC(C)(C)c1ccc(-c2ccccc2)cc1.CC(C)(C)c1ccc(CN2CCCCC2)cc1.CC(C)(C)c1ccc(Cl)s1.CC(C)(C)c1ccc2c(c1)CCO2.CC(C)(C)c1ccc2c(c1)OCCO2.CC(C)(C)c1ccccc1.CC(C)(C)c1cccs1.CC(C)(C)c1ccn[nH]1.CC(C)(C)c1ccncc1.CC(C)(C)c1ccoc1.CC(C)(C)c1ccsc1.CN(C)c1ncc(C(C)(C)C)cn1.COCc1ccc(C(C)(C)C)cc1.COc1ccc(C(C)(C)C)cc1.COc1cccc(C(C)(C)C)c1.COc1ccccc1C(C)(C)C.COc1ncc(C(C)(C)C)cn1.Cc1noc(C)c1C(C)(C)C.Cn1cc(C(C)(C)C)cn1.Cn1nccc1C(C)(C)C
InChIInChI=1S/C16H25N.C16H18.C12H16O2.C12H16O.C12H18O.C12H16.3C11H16O.C10H17N3.C10H14.C9H14N2O.C9H15NO.C9H13N.C8H11ClS.2C8H14N2.C8H12O.2C8H12S.C7H12N2/c1-16(2,3)15-9-7-14(8-10-15)13-17-11-5-4-6-12-17;1-16(2,3)15-11-9-14(10-12-15)13-7-5-4-6-8-13;1-12(2,3)9-4-5-10-11(8-9)14-7-6-13-10;1-12(2,3)10-4-5-11-9(8-10)6-7-13-11;1-12(2,3)11-7-5-10(6-8-11)9-13-4;1-12(2,3)10-9-11-7-5-4-6-8-11;1-11(2,3)9-5-7-10(12-4)8-6-9;1-11(2,3)9-6-5-7-10(8-9)12-4;1-11(2,3)9-7-5-6-8-10(9)12-4;1-10(2,3)8-6-11-9(12-7-8)13(4)5;1-10(2,3)9-7-5-4-6-8-9;1-9(2,3)7-5-10-8(12-4)11-6-7;1-6-8(9(3,4)5)7(2)11-10-6;1-9(2,3)8-4-6-10-7-5-8;1-8(2,3)6-4-5-7(9)10-6;1-8(2,3)7-5-9-10(4)6-7;1-8(2,3)7-5-6-9-10(7)4;2*1-8(2,3)7-4-5-9-6-7;1-8(2,3)7-5-4-6-9-7;1-7(2,3)6-4-5-8-9-6/h7-10H,4-6,11-13H2,1-3H3;4-12H,1-3H3;4-5,8H,6-7H2,1-3H3;4-5,8H,6-7H2,1-3H3;5-8H,9H2,1-4H3;4-10H,1-3H3;3*5-8H,1-4H3;6-7H,1-5H3;4-8H,1-3H3;5-6H,1-4H3;1-5H3;4-7H,1-3H3;4-5H,1-3H3;2*5-6H,1-4H3;3*4-6H,1-3H3;4-5H,1-3H3,(H,8,9)/b;;;;;10-9+;;;;;;;;;;;;;;;
InChIKeyMUOZXXDHLYMVER-ASWJOEFWSA-N
MW3389.64 g/mol
LogP59.23
Rot. Bonds11

About tert-butylbenzene;2-tert-butyl-5-chlorothiophene;6-tert-butyl-2,3-dihydro-1,4-benzodioxine;5-tert-butyl-2,3-dihydro-1-benzofuran;4-tert-butyl-3,5-dimethyl-1,2-oxazole;5-tert-butyl-N,N-dimethylpyrimidin-2-amine;3-tert-butylfuran;1-tert-butyl-2-methoxybenzene;1-tert-butyl-3-methoxybenzene;1-tert-butyl-4-methoxybenzene;1-tert-butyl-4-(methoxymethyl)benzene;5-tert-butyl-2-methoxypyrimidine;4-tert-butyl-1-methylpyrazole;5-tert-butyl-1-methylpyrazole;1-tert-butyl-4-phenylbenzene;1-[(4-tert-butylphenyl)methyl]piperidine;5-tert-butyl-1H-pyrazole;4-tert-butylpyridine;2-tert-butylthiophene;3-tert-butylthiophene;[(E)-3,3-dimethylbut-1-enyl]benzene

tert-butylbenzene;2-tert-butyl-5-chlorothiophene;6-tert-butyl-2,3-dihydro-1,4-benzodioxine;5-tert-butyl-2,3-dihydro-1-benzofuran;4-tert-butyl-3,5-dimethyl-1,2-oxazole;5-tert-butyl-N,N-dimethylpyrimidin-2-amine;3-tert-butylfuran;1-tert-butyl-2-methoxybenzene;1-tert-butyl-3-methoxybenzene;1-tert-butyl-4-methoxybenzene;1-tert-butyl-4-(methoxymethyl)benzene;5-tert-butyl-2-methoxypyrimidine;4-tert-butyl-1-methylpyrazole;5-tert-butyl-1-methylpyrazole;1-tert-butyl-4-phenylbenzene;1-[(4-tert-butylphenyl)methyl]piperidine;5-tert-butyl-1H-pyrazole;4-tert-butylpyridine;2-tert-butylthiophene;3-tert-butylthiophene;[(E)-3,3-dimethylbut-1-enyl]benzene (PubChem CID 159675893) has the molecular formula C215H317ClN14O10S3 and a molecular weight of 3389.64 g/mol. Its IUPAC name is tert-butylbenzene;2-tert-butyl-5-chlorothiophene;6-tert-butyl-2,3-dihydro-1,4-benzodioxine;5-tert-butyl-2,3-dihydro-1-benzofuran;4-tert-butyl-3,5-dimethyl-1,2-oxazole;5-tert-butyl-N,N-dimethylpyrimidin-2-amine;3-tert-butylfuran;1-tert-butyl-2-methoxybenzene;1-tert-butyl-3-methoxybenzene;1-tert-butyl-4-methoxybenzene;1-tert-butyl-4-(methoxymethyl)benzene;5-tert-butyl-2-methoxypyrimidine;4-tert-butyl-1-methylpyrazole;5-tert-butyl-1-methylpyrazole;1-tert-butyl-4-phenylbenzene;1-[(4-tert-butylphenyl)methyl]piperidine;5-tert-butyl-1H-pyrazole;4-tert-butylpyridine;2-tert-butylthiophene;3-tert-butylthiophene;[(E)-3,3-dimethylbut-1-enyl]benzene.

Molecular Properties

Compound Nametert-butylbenzene;2-tert-butyl-5-chlorothiophene;6-tert-butyl-2,3-dihydro-1,4-benzodioxine;5-tert-butyl-2,3-dihydro-1-benzofuran;4-tert-butyl-3,5-dimethyl-1,2-oxazole;5-tert-butyl-N,N-dimethylpyrimidin-2-amine;3-tert-butylfuran;1-tert-butyl-2-methoxybenzene;1-tert-butyl-3-methoxybenzene;1-tert-butyl-4-methoxybenzene;1-tert-butyl-4-(methoxymethyl)benzene;5-tert-butyl-2-methoxypyrimidine;4-tert-butyl-1-methylpyrazole;5-tert-butyl-1-methylpyrazole;1-tert-butyl-4-phenylbenzene;1-[(4-tert-butylphenyl)methyl]piperidine;5-tert-butyl-1H-pyrazole;4-tert-butylpyridine;2-tert-butylthiophene;3-tert-butylthiophene;[(E)-3,3-dimethylbut-1-enyl]benzene
PubChem CID159675893
Molecular FormulaC215H317ClN14O10S3
Molecular Weight3389.64 g/mol
Exact Mass3386.36
IUPAC Nametert-butylbenzene;2-tert-butyl-5-chlorothiophene;6-tert-butyl-2,3-dihydro-1,4-benzodioxine;5-tert-butyl-2,3-dihydro-1-benzofuran;4-tert-butyl-3,5-dimethyl-1,2-oxazole;5-tert-butyl-N,N-dimethylpyrimidin-2-amine;3-tert-butylfuran;1-tert-butyl-2-methoxybenzene;1-tert-butyl-3-methoxybenzene;1-tert-butyl-4-methoxybenzene;1-tert-butyl-4-(methoxymethyl)benzene;5-tert-butyl-2-methoxypyrimidine;4-tert-butyl-1-methylpyrazole;5-tert-butyl-1-methylpyrazole;1-tert-butyl-4-phenylbenzene;1-[(4-tert-butylphenyl)methyl]piperidine;5-tert-butyl-1H-pyrazole;4-tert-butylpyridine;2-tert-butylthiophene;3-tert-butylthiophene;[(E)-3,3-dimethylbut-1-enyl]benzene
SMILESCC(C)(C)/C=C/c1ccccc1.CC(C)(C)c1ccc(-c2ccccc2)cc1.CC(C)(C)c1ccc(CN2CCCCC2)cc1.CC(C)(C)c1ccc(Cl)s1.CC(C)(C)c1ccc2c(c1)CCO2.CC(C)(C)c1ccc2c(c1)OCCO2.CC(C)(C)c1ccccc1.CC(C)(C)c1cccs1.CC(C)(C)c1ccn[nH]1.CC(C)(C)c1ccncc1.CC(C)(C)c1ccoc1.CC(C)(C)c1ccsc1.CN(C)c1ncc(C(C)(C)C)cn1.COCc1ccc(C(C)(C)C)cc1.COc1ccc(C(C)(C)C)cc1.COc1cccc(C(C)(C)C)c1.COc1ccccc1C(C)(C)C.COc1ncc(C(C)(C)C)cn1.Cc1noc(C)c1C(C)(C)C.Cn1cc(C(C)(C)C)cn1.Cn1nccc1C(C)(C)C
InChIInChI=1S/C16H25N.C16H18.C12H16O2.C12H16O.C12H18O.C12H16.3C11H16O.C10H17N3.C10H14.C9H14N2O.C9H15NO.C9H13N.C8H11ClS.2C8H14N2.C8H12O.2C8H12S.C7H12N2/c1-16(2,3)15-9-7-14(8-10-15)13-17-11-5-4-6-12-17;1-16(2,3)15-11-9-14(10-12-15)13-7-5-4-6-8-13;1-12(2,3)9-4-5-10-11(8-9)14-7-6-13-10;1-12(2,3)10-4-5-11-9(8-10)6-7-13-11;1-12(2,3)11-7-5-10(6-8-11)9-13-4;1-12(2,3)10-9-11-7-5-4-6-8-11;1-11(2,3)9-5-7-10(12-4)8-6-9;1-11(2,3)9-6-5-7-10(8-9)12-4;1-11(2,3)9-7-5-6-8-10(9)12-4;1-10(2,3)8-6-11-9(12-7-8)13(4)5;1-10(2,3)9-7-5-4-6-8-9;1-9(2,3)7-5-10-8(12-4)11-6-7;1-6-8(9(3,4)5)7(2)11-10-6;1-9(2,3)8-4-6-10-7-5-8;1-8(2,3)6-4-5-7(9)10-6;1-8(2,3)7-5-9-10(4)6-7;1-8(2,3)7-5-6-9-10(7)4;2*1-8(2,3)7-4-5-9-6-7;1-8(2,3)7-5-4-6-9-7;1-7(2,3)6-4-5-8-9-6/h7-10H,4-6,11-13H2,1-3H3;4-12H,1-3H3;4-5,8H,6-7H2,1-3H3;4-5,8H,6-7H2,1-3H3;5-8H,9H2,1-4H3;4-10H,1-3H3;3*5-8H,1-4H3;6-7H,1-5H3;4-8H,1-3H3;5-6H,1-4H3;1-5H3;4-7H,1-3H3;4-5H,1-3H3;2*5-6H,1-4H3;3*4-6H,1-3H3;4-5H,1-3H3,(H,8,9)/b;;;;;10-9+;;;;;;;;;;;;;;;
InChIKeyMUOZXXDHLYMVER-ASWJOEFWSA-N
XLogP59.23
TPSA248.26 Ų
H-Bond Donors1
H-Bond Acceptors26
Rotatable Bonds11
Heavy Atoms243
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003389.64
LogP ≤ 559.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1026

Analyze tert-butylbenzene;2-tert-butyl-5-chlorothiophene;6-tert-butyl-2,3-dihydro-1,4-benzodioxine;5-tert-butyl-2,3-dihydro-1-benzofuran;4-tert-butyl-3,5-dimethyl-1,2-oxazole;5-tert-butyl-N,N-dimethylpyrimidin-2-amine;3-tert-butylfuran;1-tert-butyl-2-methoxybenzene;1-tert-butyl-3-methoxybenzene;1-tert-butyl-4-methoxybenzene;1-tert-butyl-4-(methoxymethyl)benzene;5-tert-butyl-2-methoxypyrimidine;4-tert-butyl-1-methylpyrazole;5-tert-butyl-1-methylpyrazole;1-tert-butyl-4-phenylbenzene;1-[(4-tert-butylphenyl)methyl]piperidine;5-tert-butyl-1H-pyrazole;4-tert-butylpyridine;2-tert-butylthiophene;3-tert-butylthiophene;[(E)-3,3-dimethylbut-1-enyl]benzene with MolForge

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Frequently Asked Questions

What is the IUPAC name of tert-butylbenzene;2-tert-butyl-5-chlorothiophene;6-tert-butyl-2,3-dihydro-1,4-benzodioxine;5-tert-butyl-2,3-dihydro-1-benzofuran;4-tert-butyl-3,5-dimethyl-1,2-oxazole;5-tert-butyl-N,N-dimethylpyrimidin-2-amine;3-tert-butylfuran;1-tert-butyl-2-methoxybenzene;1-tert-butyl-3-methoxybenzene;1-tert-butyl-4-methoxybenzene;1-tert-butyl-4-(methoxymethyl)benzene;5-tert-butyl-2-methoxypyrimidine;4-tert-butyl-1-methylpyrazole;5-tert-butyl-1-methylpyrazole;1-tert-butyl-4-phenylbenzene;1-[(4-tert-butylphenyl)methyl]piperidine;5-tert-butyl-1H-pyrazole;4-tert-butylpyridine;2-tert-butylthiophene;3-tert-butylthiophene;[(E)-3,3-dimethylbut-1-enyl]benzene?
The IUPAC name of tert-butylbenzene;2-tert-butyl-5-chlorothiophene;6-tert-butyl-2,3-dihydro-1,4-benzodioxine;5-tert-butyl-2,3-dihydro-1-benzofuran;4-tert-butyl-3,5-dimethyl-1,2-oxazole;5-tert-butyl-N,N-dimethylpyrimidin-2-amine;3-tert-butylfuran;1-tert-butyl-2-methoxybenzene;1-tert-butyl-3-methoxybenzene;1-tert-butyl-4-methoxybenzene;1-tert-butyl-4-(methoxymethyl)benzene;5-tert-butyl-2-methoxypyrimidine;4-tert-butyl-1-methylpyrazole;5-tert-butyl-1-methylpyrazole;1-tert-butyl-4-phenylbenzene;1-[(4-tert-butylphenyl)methyl]piperidine;5-tert-butyl-1H-pyrazole;4-tert-butylpyridine;2-tert-butylthiophene;3-tert-butylthiophene;[(E)-3,3-dimethylbut-1-enyl]benzene (CID 159675893) is tert-butylbenzene;2-tert-butyl-5-chlorothiophene;6-tert-butyl-2,3-dihydro-1,4-benzodioxine;5-tert-butyl-2,3-dihydro-1-benzofuran;4-tert-butyl-3,5-dimethyl-1,2-oxazole;5-tert-butyl-N,N-dimethylpyrimidin-2-amine;3-tert-butylfuran;1-tert-butyl-2-methoxybenzene;1-tert-butyl-3-methoxybenzene;1-tert-butyl-4-methoxybenzene;1-tert-butyl-4-(methoxymethyl)benzene;5-tert-butyl-2-methoxypyrimidine;4-tert-butyl-1-methylpyrazole;5-tert-butyl-1-methylpyrazole;1-tert-butyl-4-phenylbenzene;1-[(4-tert-butylphenyl)methyl]piperidine;5-tert-butyl-1H-pyrazole;4-tert-butylpyridine;2-tert-butylthiophene;3-tert-butylthiophene;[(E)-3,3-dimethylbut-1-enyl]benzene.
What is the SMILES notation for tert-butylbenzene;2-tert-butyl-5-chlorothiophene;6-tert-butyl-2,3-dihydro-1,4-benzodioxine;5-tert-butyl-2,3-dihydro-1-benzofuran;4-tert-butyl-3,5-dimethyl-1,2-oxazole;5-tert-butyl-N,N-dimethylpyrimidin-2-amine;3-tert-butylfuran;1-tert-butyl-2-methoxybenzene;1-tert-butyl-3-methoxybenzene;1-tert-butyl-4-methoxybenzene;1-tert-butyl-4-(methoxymethyl)benzene;5-tert-butyl-2-methoxypyrimidine;4-tert-butyl-1-methylpyrazole;5-tert-butyl-1-methylpyrazole;1-tert-butyl-4-phenylbenzene;1-[(4-tert-butylphenyl)methyl]piperidine;5-tert-butyl-1H-pyrazole;4-tert-butylpyridine;2-tert-butylthiophene;3-tert-butylthiophene;[(E)-3,3-dimethylbut-1-enyl]benzene?
The canonical SMILES for tert-butylbenzene;2-tert-butyl-5-chlorothiophene;6-tert-butyl-2,3-dihydro-1,4-benzodioxine;5-tert-butyl-2,3-dihydro-1-benzofuran;4-tert-butyl-3,5-dimethyl-1,2-oxazole;5-tert-butyl-N,N-dimethylpyrimidin-2-amine;3-tert-butylfuran;1-tert-butyl-2-methoxybenzene;1-tert-butyl-3-methoxybenzene;1-tert-butyl-4-methoxybenzene;1-tert-butyl-4-(methoxymethyl)benzene;5-tert-butyl-2-methoxypyrimidine;4-tert-butyl-1-methylpyrazole;5-tert-butyl-1-methylpyrazole;1-tert-butyl-4-phenylbenzene;1-[(4-tert-butylphenyl)methyl]piperidine;5-tert-butyl-1H-pyrazole;4-tert-butylpyridine;2-tert-butylthiophene;3-tert-butylthiophene;[(E)-3,3-dimethylbut-1-enyl]benzene is CC(C)(C)/C=C/c1ccccc1.CC(C)(C)c1ccc(-c2ccccc2)cc1.CC(C)(C)c1ccc(CN2CCCCC2)cc1.CC(C)(C)c1ccc(Cl)s1.CC(C)(C)c1ccc2c(c1)CCO2.CC(C)(C)c1ccc2c(c1)OCCO2.CC(C)(C)c1ccccc1.CC(C)(C)c1cccs1.CC(C)(C)c1ccn[nH]1.CC(C)(C)c1ccncc1.CC(C)(C)c1ccoc1.CC(C)(C)c1ccsc1.CN(C)c1ncc(C(C)(C)C)cn1.COCc1ccc(C(C)(C)C)cc1.COc1ccc(C(C)(C)C)cc1.COc1cccc(C(C)(C)C)c1.COc1ccccc1C(C)(C)C.COc1ncc(C(C)(C)C)cn1.Cc1noc(C)c1C(C)(C)C.Cn1cc(C(C)(C)C)cn1.Cn1nccc1C(C)(C)C.
What is the InChIKey of tert-butylbenzene;2-tert-butyl-5-chlorothiophene;6-tert-butyl-2,3-dihydro-1,4-benzodioxine;5-tert-butyl-2,3-dihydro-1-benzofuran;4-tert-butyl-3,5-dimethyl-1,2-oxazole;5-tert-butyl-N,N-dimethylpyrimidin-2-amine;3-tert-butylfuran;1-tert-butyl-2-methoxybenzene;1-tert-butyl-3-methoxybenzene;1-tert-butyl-4-methoxybenzene;1-tert-butyl-4-(methoxymethyl)benzene;5-tert-butyl-2-methoxypyrimidine;4-tert-butyl-1-methylpyrazole;5-tert-butyl-1-methylpyrazole;1-tert-butyl-4-phenylbenzene;1-[(4-tert-butylphenyl)methyl]piperidine;5-tert-butyl-1H-pyrazole;4-tert-butylpyridine;2-tert-butylthiophene;3-tert-butylthiophene;[(E)-3,3-dimethylbut-1-enyl]benzene?
The InChIKey is MUOZXXDHLYMVER-ASWJOEFWSA-N. The full InChI is InChI=1S/C16H25N.C16H18.C12H16O2.C12H16O.C12H18O.C12H16.3C11H16O.C10H17N3.C10H14.C9H14N2O.C9H15NO.C9H13N.C8H11ClS.2C8H14N2.C8H12O.2C8H12S.C7H12N2/c1-16(2,3)15-9-7-14(8-10-15)13-17-11-5-4-6-12-17;1-16(2,3)15-11-9-14(10-12-15)13-7-5-4-6-8-13;1-12(2,3)9-4-5-10-11(8-9)14-7-6-13-10;1-12(2,3)10-4-5-11-9(8-10)6-7-13-11;1-12(2,3)11-7-5-10(6-8-11)9-13-4;1-12(2,3)10-9-11-7-5-4-6-8-11;1-11(2,3)9-5-7-10(12-4)8-6-9;1-11(2,3)9-6-5-7-10(8-9)12-4;1-11(2,3)9-7-5-6-8-10(9)12-4;1-10(2,3)8-6-11-9(12-7-8)13(4)5;1-10(2,3)9-7-5-4-6-8-9;1-9(2,3)7-5-10-8(12-4)11-6-7;1-6-8(9(3,4)5)7(2)11-10-6;1-9(2,3)8-4-6-10-7-5-8;1-8(2,3)6-4-5-7(9)10-6;1-8(2,3)7-5-9-10(4)6-7;1-8(2,3)7-5-6-9-10(7)4;2*1-8(2,3)7-4-5-9-6-7;1-8(2,3)7-5-4-6-9-7;1-7(2,3)6-4-5-8-9-6/h7-10H,4-6,11-13H2,1-3H3;4-12H,1-3H3;4-5,8H,6-7H2,1-3H3;4-5,8H,6-7H2,1-3H3;5-8H,9H2,1-4H3;4-10H,1-3H3;3*5-8H,1-4H3;6-7H,1-5H3;4-8H,1-3H3;5-6H,1-4H3;1-5H3;4-7H,1-3H3;4-5H,1-3H3;2*5-6H,1-4H3;3*4-6H,1-3H3;4-5H,1-3H3,(H,8,9)/b;;;;;10-9+;;;;;;;;;;;;;;;.
What are the key properties of tert-butylbenzene;2-tert-butyl-5-chlorothiophene;6-tert-butyl-2,3-dihydro-1,4-benzodioxine;5-tert-butyl-2,3-dihydro-1-benzofuran;4-tert-butyl-3,5-dimethyl-1,2-oxazole;5-tert-butyl-N,N-dimethylpyrimidin-2-amine;3-tert-butylfuran;1-tert-butyl-2-methoxybenzene;1-tert-butyl-3-methoxybenzene;1-tert-butyl-4-methoxybenzene;1-tert-butyl-4-(methoxymethyl)benzene;5-tert-butyl-2-methoxypyrimidine;4-tert-butyl-1-methylpyrazole;5-tert-butyl-1-methylpyrazole;1-tert-butyl-4-phenylbenzene;1-[(4-tert-butylphenyl)methyl]piperidine;5-tert-butyl-1H-pyrazole;4-tert-butylpyridine;2-tert-butylthiophene;3-tert-butylthiophene;[(E)-3,3-dimethylbut-1-enyl]benzene?
tert-butylbenzene;2-tert-butyl-5-chlorothiophene;6-tert-butyl-2,3-dihydro-1,4-benzodioxine;5-tert-butyl-2,3-dihydro-1-benzofuran;4-tert-butyl-3,5-dimethyl-1,2-oxazole;5-tert-butyl-N,N-dimethylpyrimidin-2-amine;3-tert-butylfuran;1-tert-butyl-2-methoxybenzene;1-tert-butyl-3-methoxybenzene;1-tert-butyl-4-methoxybenzene;1-tert-butyl-4-(methoxymethyl)benzene;5-tert-butyl-2-methoxypyrimidine;4-tert-butyl-1-methylpyrazole;5-tert-butyl-1-methylpyrazole;1-tert-butyl-4-phenylbenzene;1-[(4-tert-butylphenyl)methyl]piperidine;5-tert-butyl-1H-pyrazole;4-tert-butylpyridine;2-tert-butylthiophene;3-tert-butylthiophene;[(E)-3,3-dimethylbut-1-enyl]benzene has a molecular weight of 3389.64 g/mol, XLogP of 59.23, 11 rotatable bonds, 1 hydrogen bond donors, and 26 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butylbenzene;2-tert-butyl-5-chlorothiophene;6-tert-butyl-2,3-dihydro-1,4-benzodioxine;5-tert-butyl-2,3-dihydro-1-benzofuran;4-tert-butyl-3,5-dimethyl-1,2-oxazole;5-tert-butyl-N,N-dimethylpyrimidin-2-amine;3-tert-butylfuran;1-tert-butyl-2-methoxybenzene;1-tert-butyl-3-methoxybenzene;1-tert-butyl-4-methoxybenzene;1-tert-butyl-4-(methoxymethyl)benzene;5-tert-butyl-2-methoxypyrimidine;4-tert-butyl-1-methylpyrazole;5-tert-butyl-1-methylpyrazole;1-tert-butyl-4-phenylbenzene;1-[(4-tert-butylphenyl)methyl]piperidine;5-tert-butyl-1H-pyrazole;4-tert-butylpyridine;2-tert-butylthiophene;3-tert-butylthiophene;[(E)-3,3-dimethylbut-1-enyl]benzene is sourced from PubChem (CID 159675893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).