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| CAS Number | 98-29-3 |
| Catalog Number | AG003M1Y(AGN-PC-0JK82C) |
| Chemical Name | 4-(tert-Butyl)benzene-1,2-diol |
| EC Number | 202-653-9 |
| IUPAC Name | 4-tert-butylbenzene-1,2-diol |
| InChI | InChI=1S/C10H14O2/c1-10(2,3)7-4-5-8(11)9(12)6-7/h4-6,11-12H,1-3H3 |
| InChI Key | XESZUVZBAMCAEJ-UHFFFAOYSA-N |
| MDL Number | MFCD00002201 |
| Molecular Formula | C10H14O2 |
| Molecular Weight | 166.2170 |
| NSC Number | 5310 |
| RTECS Number | UX1400000 |
| SMILES | OC1=CC=C(C(C)(C)C)C=C1O |
| UNII | 9A069144KR |
| Synonyms | 4-tert-butyl catechol,
4-tert-butylcatechol,
4-tertiary butyl catechol,
p-tert-butyl catechol,
para-tert-butyl catechol,
4-tert-Butylcatechol,
98-29-3,
p-tert-Butylcatechol,
4-(tert-butyl)benzene-1,2-diol,
4-tert-Butylpyrocatechol,
4-tert-butylbenzene-1,2-diol,
p-tert-Butyl catechol,
4-t-Butylpyrocatechol,
p-tert-Butylpyrocatechol,
4-T-BUTYLCATECHOL,
1,2-Benzenediol, 4-(1,1-dimethylethyl)-,
4-tert-Butylcatechin,
p-t-Butylpyrocatechol,
t-Butyl catechol,
Pyrocatechol, 4-tert-butyl-,
Synox TBC,
4-tert-Butyl-1,2-benzenediol,
4-TBC,
1,2-Dihydroxy-4-tert-butylbenzene,
4-tert-Butyl-1,2-dihydroxybenzene,
4-tert-Butylpyrokatechin,
4-tert-Butyl-pyrocatechol,
NSC 5310,
CCRIS 3332,
UNII-9A069144KR,
4-tert-butyl catechol,
4-tert-Butylpyrokatechin [Czech],
EINECS 202-653-9,
MFCD00002201,
BRN 2043335,
AI3-24363,
XESZUVZBAMCAEJ-UHFFFAOYSA-N,
9A069144KR,
NCGC00091483-03,
4-(1,1-Dimethylethyl)-1,2-benzenediol,
DSSTox_CID_4687,
DSSTox_RID_77499,
DSSTox_GSID_24687,
4-tert-Butylcatechol, 99%,
CAS-98-29-3,
4-t-butyl catechol,
p-tertbutylcatechol,
4-tertbutylcatechol,
diallyl butanedioate,
p-t-butyl catechol,
4- t-Butylcatechol,
4-tert-butylcathechol,
p-tert.-butylcatechol,
para-tert-Butylcatechol,
PubChem14587,
4k7o,
4-tert.-butyl-catechol,
4-tertiarybutyl catechol,
para-tert-butyl catechol,
AC1L1OMS,
AC1Q7ABW,
ACMC-209s9z,
4-(tert-butyl)pyrocatechol,
4-(tertbutyl)-pyrocatechol,
4-tert.-butyl pyrocatechol,
EC 202-653-9,
4-(tert-butyl)-pyrocatechol,
SCHEMBL50705,
4-t-Butyl-1,2-benzenediol,
4-06-00-06014 (Beilstein Handbook Reference),
KSC486S1R,
MLS001065578,
BIDD:ER0238,
CHEMBL220845,
4-(1,1-Dimethylethyl)catechol,
DTXSID5024687,
1, 4-(1,1-dimethylethyl)-,
CTK3I6918,
KS-00000JSQ,
NSC5310,
ZINC388150,
4-tert-Butylcatechol, >=99.0%,
ACT03279,
NSC-5310,
Tox21_202989,
Tox21_400003,
ANW-40917,
BBL011511,
SBB061378,
STL146627,
AKOS000119685,
CS-W017861,
LS-2042,
MCULE-6988116335,
NE10153,
RP22933,
RTR-030676,
TRA0068164,
NCGC00091483-01,
NCGC00091483-02,
NCGC00091483-04,
NCGC00091483-05,
NCGC00260534-01,
WLN: QR BQ DX1 & 1 & 1,
4-tert-Butylcatechol (CAS 98-29-3),
AC-10567,
AJ-20454,
AK-48632,
AN-24480,
BC650603,
BP-30171,
CJ-03131,
K765,
SC-22458,
SMR000568493,
ZB011319,
4-tert-Butylcatechol, >=98.0% (HPLC),
AB1009503,
DB-057718,
ST2411038,
TR-030676,
B0739,
FT-0082784,
FT-0619505,
FT-0703873,
ST50824899,
4-tert-Butylcatechol, SAJ first grade, >=98.0%,
I01-6056,
Q-200510,
Q-200511,
4-tert-Butylcatechol, technical, flakes, >=98% (HPLC),
F1995-0233,
Z1262246171,
UNII-06J124VX0O component XESZUVZBAMCAEJ-UHFFFAOYSA-N,
TBC; 4-(1,1-Dimethylethyl)-1,2-benzenediol; 4-tert-Butylpyrocatechol,
4-tert-Butylcatechol solution, >=98% (calc. to the dried substance, GC), liquid,
InChI=1/C10H14O2/c1-10(2,3)7-4-5-8(11)9(12)6-7/h4-6,11-12H,1-3H,
EKZ,
t-butylcatechol,
tert-Butylcatechol,
terc-butilcatecol,
4-Pyridinepropanol,
tert-Butylpyrocatechin,
tert-Butylpyrocatechol,
Pirocatecol, terc-butil-,
Pyrocatechol, tert-butyl-,
tert-Butyl-12-benzenediol,
terc-butil-1,2-bencenodiol,
C10H14O2,
UNII-06J124VX0O,
CID7381,
Pyrocatechol tert-butyl-(7CI8CI),
4-tert-Butylcatechol, 98% 250g,
EINECS 248-325-9,
AR-1G4740,
ZINC00388150,
1,2-Benzenediol, (1,1-dimethylethyl)-,
1,2-Dihydroxy-4-(dimethylethyl)benzol,
C10-H14-O2,
1,2-Bencenodiol, (1,1-dimetiletil)-,
4-tert-Butylcatechol, 99% - 100G 100g,
4-Tert-Butyl Catechol 98% extra pure 500gm,
Butylpyrocatechol, 4-tert-; (4-tert-Butylcatechol),
TBC,
27213-78-1,
105-09-9,
5472-03-7,
|
| Complexity | 148 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 166.099g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 166.22g/mol |
| Monoisotopic Mass | 166.099g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 40.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.7 |
| Symbol: | |
| Hazard Class | 8 |
| Hazard statements | H315-H319-H226-H302+H332-H311-H314-H317-H370-H410-H302+H312-H303-H318-H401-H411 |
| Packing Group | Ⅱ |
| Precautionary statements | P260h-P301+P330+P331-P501a-P261-P264-P272-P302+P352+P312+P361+P364-P305+P351+P338+P337+P313-P405-P210-P260-P280-P303+P361+P353-P304+P340+P310-P305+P351+P338-P308+P311-P273-P310-P501 |
| UN Code | UN 3261 |
| Chemical Name: | Batch Number: | |
| Chemical Structure: | CAS Registry No: | |
| Product ID: | ||
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