Results for:
PubChem ID: 73219

3,5-ditert-butyl-4-hydroxybenzaldehyde

Compound Details

Synonymous names	3,5-Di-tert-butyl-4-hydroxybenzaldehyde 1620-98-0 Benzaldehyde, 3,5-bis(1,1-dimethylethyl)-4-hydroxy- 3,5-ditert-butyl-4-hydroxybenzaldehyde 3,5-Di-t-butyl-4-hydroxybenzaldehyde Benzaldehyde, 3,5-di-tert-butyl-4-hydroxy- MFCD00008826 3,5-bis(tert-butyl)-4-hydroxybenzaldehyde 95VTI93VUL DTXSID7057658 4-Formyl-2,6-di-tert-butylphenol NSC-14450 3,5-bis(1,1-dimethylethyl)-4-hydroxybenzaldehyde EINECS 216-592-0 NSC 14450 UNII-95VTI93VUL BRN 0982526 3,5-ditert-Butyl-4-hydroxy-benzaldehyde 3,5-Di-tert-butyl-4-hydroxy-benzaldehyde 2,6-Di-tert-Butyl-4-formylphenol NSC14450 4-Hydroxy-3,5-di-tert-butylbenzaldehyde 3,5-di(Tert-butyl)-4-hydroxybenzaldehyde SCHEMBL85764 4-08-00-00601 (Beilstein Handbook Reference) CHEMBL225623 DTXCID8031447 SCHEMBL22930710 CHEBI:170060 MAADFVPSLRWBIA-UHFFFAOYSA-N BCP04892 Tox21_113770 3,5-di-t-butyl4-hydroxybenzaldehyde BBL010515 STK397393 AKOS000113376 CS-W012903 MCULE-4024560770 MS-3676 3,5,-di-t-butyl-4-hydroxybenzaldehyde 3,5-Di-t-butyl-4-hydroxy benzaldehyde 3,5-ditert.butyl-4-hydroxybenzaldehyde 3,5-di tert.butyl-4-hydroxybenzaldehyde 3,5-di-tert-butyl 4-hydroxybenzaldehyde 3,5-di-tert.butyl-4-hydroxybenzaldehyde Benzaldehyde,5-di-tert-butyl-4-hydroxy- NCGC00253643-01 NCGC00253643-02 AC-10539 3,5- di-tert-butyl-4-hydroxybenzaldehyde 3,5-di-tert-butyl-4-hydrox-ybenzaldehyde 3,5-di-tert.-butyl-4-hydroxybenzaldehyde 3,5-di-tert.butyl-4-hydroxy benzaldehyde 4-hydroxy-3,5-di-tert.-butylbenzaldehyde CAS-1620-98-0 3,5-Di-(tert-butyl)-4-hydroxybenzaldehyde Benzaldehyde, 4-hydroxy-3,5-di-tert-butyl DB-022118 3,5-di-tertiary-butyl-4-hydroxybenzaldehyde AM20050056 NS00009935 EN300-17563 Benzoic aldehyde, 3,5-di-t-butyl-4-hydroxy- AB01324450-02 3,5-di0T0butyl-4-hydroxybenzaldehyde*hemihydrate A810339 AE-641/02487004 Benzaldehyde,5-bis(1,1-dimethylethyl)-4-hydroxy- SR-01000944840 3,5-Ditert-butyl-4-hydroxybenzaldehyde, AldrichCPR SR-01000944840-1 W-107967 Q27271830 Z56957492 F1673-1281 2,6-Ditert-butyl-4-(hydroxymethylene)-2,5-cyclohexadien-1-one # 2,3,5,6-Detetrahydrocyclohexanone, 2,6-di-t-butyl-4-hydroxymethylene- 3-TERT-BUTYL-2-HYDROXY-.BETA.,.BETA.,5-TRIMETHYLBENZENEETHYL-.BETA.-D-GLUCOSIDURONATE InChI=1/C15H22O2/c1-14(2,3)11-7-10(9-16)8-12(13(11)17)15(4,5)6/h7-9,17H,1-6H
Microorganism:	Yes
IUPAC name	3,5-ditert-butyl-4-hydroxybenzaldehyde
SMILES	CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C=O
Inchi	InChI=1S/C15H22O2/c1-14(2,3)11-7-10(9-16)8-12(13(11)17)15(4,5)6/h7-9,17H,1-6H3
Formula	C15H22O2
PubChem ID	73219
Molweight	234.33
LogP	4.4
Atoms	17
Bonds	3
H-bond Acceptor	2
H-bond Donor	1
Chemical Classification	aromatic aldehydes aldehydes phenols benzaldehydes
CHEBI-ID	170060
Supernatural-ID	SN0071594

mVOC Specific Details

Massbank-Links

Massbank Spectrum MSBNK-Antwerp_Univ-AN113101 Massbank Spectrum MSBNK-Antwerp_Univ-AN113102 Massbank Spectrum MSBNK-Antwerp_Univ-AN113103 Massbank Spectrum MSBNK-Antwerp_Univ-AN113104 Massbank Spectrum MSBNK-Antwerp_Univ-AN113105 Massbank Spectrum MSBNK-Antwerp_Univ-AN113106 Massbank Spectrum MSBNK-Antwerp_Univ-AN113107 Massbank Spectrum MSBNK-Antwerp_Univ-AN113108 Massbank Spectrum MSBNK-Antwerp_Univ-AN113109 Massbank Spectrum MSBNK-Antwerp_Univ-AN113110 Massbank Spectrum MSBNK-Antwerp_Univ-AN113111 Massbank Spectrum MSBNK-Antwerp_Univ-AN113112 Massbank Spectrum MSBNK-Fac_Eng_Univ_Tokyo-JP010569

Species emitting the compound	Kingdom Species Biological Function Origin/Habitat Reference Eukaryota Candida Albicans ATCC MYA-2876, American Type Culture Collection Costa et al. 2020 Eukaryota Candida Glabrata ATCC 90030, American Type Culture Collection Costa et al. 2020 Eukaryota Candida Tropicalis ATCC 750, American Type Culture Collection Costa et al. 2020
Method	Kingdom Species Growth Medium Applied Method Verification Eukaryota Candida Albicans YGC media HS-SPME/GC-GC-ToFMS no Eukaryota Candida Glabrata YGC media HS-SPME/GC-GC-ToFMS no Eukaryota Candida Tropicalis YGC media HS-SPME/GC-GC-ToFMS no