3-(m-Butylphenoxy)-1,2-propanediol

Modify Date: 2025-08-25 14:49:09

3-(m-Butylphenoxy)-1,2-propanediol Structure
3-(m-Butylphenoxy)-1,2-propanediol structure
Common Name 3-(m-Butylphenoxy)-1,2-propanediol
CAS Number 63834-63-9 Molecular Weight 224.29600
Density 1.08g/cm3 Boiling Point 385.7ºC at 760 mmHg
Molecular Formula C13H20O3 Melting Point N/A
MSDS N/A Flash Point 187.1ºC

 Names

Name 3-(3-butylphenoxy)propane-1,2-diol

 Chemical & Physical Properties

Density 1.08g/cm3
Boiling Point 385.7ºC at 760 mmHg
Molecular Formula C13H20O3
Molecular Weight 224.29600
Flash Point 187.1ºC
Exact Mass 224.14100
PSA 49.69000
LogP 1.76120
Index of Refraction 1.528
InChIKey CZWHCHAGVJACTE-UHFFFAOYSA-N
SMILES CCCCc1cccc(OCC(O)CO)c1

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
TY3890000
CHEMICAL NAME :
1,2-Propanediol, 3-(m-butylphenoxy)-
CAS REGISTRY NUMBER :
63834-63-9
BEILSTEIN REFERENCE NO. :
3270058
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C13-H20-O3
MOLECULAR WEIGHT :
224.33
WISWESSER LINE NOTATION :
Q1YQ1OR C4

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
200 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
YKKZAJ Yakugaku Zasshi. Journal of Pharmacy. (Nippon Yakugakkai, 2-12-15 Shibuya, Shibuya-ku, Tokyo 150, Japan) No.1- 1881- Volume(issue)/page/year: 72,1545,1952

 Safety Information

HS Code 2909499000

 Synthetic Route

~%

3-(m-Butylphenoxy)-1,2-propanediol Structure

3-(m-Butylpheno...

CAS#:63834-63-9

Literature: Kariyone et al. Yakugaku Zasshi, 1952 , vol. 72, p. 1545 Chem.Abstr., 1953 , p. 9314

 Customs

HS Code 2909499000
Summary 2909499000. ether-alcohols and their halogenated, sulphonated, nitrated or nitrosated derivatives. VAT:17.0%. Tax rebate rate:9.0%. . MFN tariff:5.5%. General tariff:30.0%
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