AG003MYM

2725-53-3 | 5-(tert-Butyl)-2-hydroxybenzaldehyde

AG003MYM

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CAS Number	2725-53-3
Catalog Number	AG003MYM(AGN-PC-0K5QBH)
Chemical Name	5-(tert-Butyl)-2-hydroxybenzaldehyde
IUPAC Name	5-tert-butyl-2-hydroxybenzaldehyde
InChI	InChI=1S/C11H14O2/c1-11(2,3)9-4-5-10(13)8(6-9)7-12/h4-7,13H,1-3H3
InChI Key	ZVCQQLGWGRTXGC-UHFFFAOYSA-N
MDL Number	MFCD01321335
Molecular Formula	C11H14O2
Molecular Weight	178.2277
SMILES	CC(C)(C)C1=CC(C=O)=C(O)C=C1
Synonyms	2725-53-3, 5-tert-Butyl-2-hydroxybenzaldehyde, 5-tert-Butylsalicylaldehyde, 5-(tert-butyl)-2-hydroxybenzaldehyde, 5-tert-Butyl-2-hydroxy-benzaldehyde, Benzaldehyde,5-(1,1-dimethylethyl)-2-hydroxy-, ZVCQQLGWGRTXGC-UHFFFAOYSA-N, Benzaldehyde, 5-(1,1-dimethylethyl)-2-hydroxy-, Benzaldehyde, 2-hydroxy, 5-(t-butyl), 5-(tert-butyl)-2-hydroxybenzenecarbaldehyde, 5-t-Butyl-2-hydroxybenzaldehyde, zlchem 670, PubChem19674, ACMC-20a2xz, AC1LROS5, SCHEMBL332380, CTK4F9361, KS-00000GCR, DTXSID20363063, ZLD0122, 2-hydroxy-5-tert-butylbenzaldehyde, ACT05911, ZINC1387078, ANW-54741, GEO-02512, MFCD01321335, STK006382, 5-(1,1-dimethylethyl)salicylaldehyde, 5-tert-butyl-2-oxidanyl-benzaldehyde, AKOS000104230, 5- tert -Butyl-2-hydroxy-benzaldehyde, AS05545, CB-4022, CM11867, CS-W017321, LS10069, MCULE-4627759525, QC-3542, VZ30565, AJ-25454, AK-25694, AN-16363, EN001342, SC-27977, ZB016725, 5-tert-Butyl-2-hydroxybenzaldehyde, 98%, AB0071720, AB1010160, DB-007106, TC-143486, FT-0600835, ST51038469, S-8052, 5-[(1,1-dimethyl)ethyl]-2-hydroxybenzaldehyde, 11N-951, A818979, S01-0169, 5-(1,1-DIMETHYLETHYL)-2-HYDROXY-BENZALDEHYDE, null, 5-tert-butyl salicylaldehyde, 5-tert-Butyl-2- hydroxybenzaldehyde, ZINC01387078, ACN-025751, CID1475090, CS-O-13931,

Complexity	181
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	178.099g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	178.231g/mol
Monoisotopic Mass	178.099g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	37.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard statements	H302-H315-H319-H332-H335
Precuationary statements	P261-P280-P305+P351+P338
Siginal words

Certificate of Analysis

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