CAS:3609-50-5 / 4-(2-hydroxypropan-2-yl)benzoic acid--Hangzhou Chempro Technology Co., Ltd.

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CAS Number: 3609-50-5
4-(2-hydroxypropan-2-yl)benzoic acid

Structure
Name: 4-(2-hydroxypropan-2-yl)benzoic acid
Synonyms:

General Information

Product Number: 3609505

CAS Registry Number 3609-50-5
Name:
Benzoic acid, 4-(1-hydroxy-1-methylethyl)-
Benzoic acid, p-(1-hydroxy-1-methylethyl)- (6CI,7CI,8CI)
4-(1-Hydroxy-1-methylethyl)benzoic acid
4-(2-Hydroxypropan-2-yl)benzoic acid
NSC 16263

Chemical Formula: C10H12O3
Exact Mass: 180.08
Molecular Weight: 180.20
m/z: 180.08 (100.0%), 181.08 (11.1%)

InChI:InChI=1S/C10H12O3/c1-10(2,13)8-5-3-7(4-6-8)9(11)12/h3-6,13H,1-2H3,(H,11,12)

InChI Key:SLFZJKUFAVHARP-UHFFFAOYSA-N

Canonical SMILES:CC(C)(C1=CC=C(C=C1)C(=O)O)O

Thermal Properties	Value	Condition	Note
Melting Point	162 °C		(2)CAS
Melting Point	157-158 °C		(3)CAS
Melting Point	156-157 °C		(4)CAS
Melting Point	156-157 °C		(5)CAS
Melting Point	156-157 °C		(6)CAS
Melting Point	154-156 °C	Solv: water (7732-18-5)	(7)CAS

Specification

98%

References

(2) Treibs, W.; Berichte der Deutschen Chemischen Gesellschaft [Abteilung] B: Abhandlungen 1935, V68B, P1041-9 CAPLUS
(3) Bruun, Torger; Kgl. Norske Videnskab. Selskabs Skrifter 1952, (No. 4), P85 pp. CAPLUS
(4) Blumann, A.; Berichte der Deutschen Chemischen Gesellschaft [Abteilung] B: Abhandlungen 1921, V54B, P887-94 CAPLUS
(5) Leone, P.; Gazzetta Chimica Italiana 1921, V51(II), P391-5 CAPLUS
(6) Tomaszewska, Lucyna; Roczniki Chemii 1961, V35, P1597-609 CAPLUS
(7) Petropoulos, John C.; US 3102135 1963 CAPLUS

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