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Merck
CN

30751

mono-Butyl phthalate

analytical standard

Synonym(s):

MBP, Phthalic acid butyl ester, mono-n-Butyl phthalate

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About This Item

Empirical Formula (Hill Notation):
C12H14O4
CAS Number:
131-70-4
Molecular Weight:
222.24
UNSPSC Code:
85151701
NACRES:
NA.24
PubChem Substance ID:
329753577
EC Number:
205-036-2
Beilstein/REAXYS Number:
2051402
MDL number:
MFCD00043498

Key Documents

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Product Name

mono-Butyl phthalate, analytical standard

SMILES string

CCCCOC(=O)c1ccccc1C(O)=O

InChI key

YZBOVSFWWNVKRJ-UHFFFAOYSA-N

InChI

1S/C12H14O4/c1-2-3-8-16-12(15)10-7-5-4-6-9(10)11(13)14/h4-7H,2-3,8H2,1H3,(H,13,14)

grade

analytical standard

shelf life

limited shelf life, expiry date on the label

technique(s)

HPLC: suitable
gas chromatography (GC): suitable

application(s)

cleaning products
cosmetics
environmental
food and beverages
personal care

format

neat

Quality Level

100

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Application

Refer to the product′s Certificate of Analysis for more information on a suitable instrument technique. Contact Technical Service for further support.

Other Notes

Find a digital Reference Material for this product available on our online platform ChemisTwin® for NMR. You can use this digital equivalent on ChemisTwin® for your sample identity confirmation and compound quantification (with digital external standard). An NMR spectrum of this substance can be viewed and an online comparison against your sample can be performed with a few mouseclicks. Learn more here and start your free trial.

pictograms

Health hazard
GHS08

signalword

Danger

hcodes

H360

Hazard Classifications

Repr. 1B

Storage Class

6.1C - Combustible acute toxic Cat.3 / toxic compounds or compounds which causing chronic effects

wgk

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

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Certificates of Analysis (COA)

Lot/Batch Number
BCCN6404
BCCK6149
BCCG3298
BCCD9766
BCBX1156

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Nancy Mervish et al.
Environmental research, 133, 12-19 (2014-06-07)
Exposures of children to phthalates, parabens, and bisphenol-A (BPA) are of concern because of their hormonal potential. These agents are found in a wide range of foods and packaging. We investigated whether intake of certain foods predict exposures to these
Krista L Y Christensen et al.
Regulatory toxicology and pharmacology : RTP, 69(3), 380-389 (2014-05-13)
Exposures to multiple chemicals may contribute to increased risk of similar adverse effects. Cumulative risk may be estimated using a hazard index (HI), the sum of individual hazard quotients (HQ, ratio of exposure to the reference value). We demonstrate the
Xiugong Gao et al.
PloS one, 9(9), e108510-e108510 (2014-09-24)
The Tox21 program calls for transforming toxicology testing from traditional in vivo tests to less expensive and higher throughput in vitro methods. In developmental toxicology, a spectrum of alternative methods including cell line based tests has been developed. In particular
Kelly K Ferguson et al.
Environmental science & technology, 48(12), 7018-7025 (2014-05-23)
Phthalate exposure during pregnancy has been linked to adverse birth outcomes such as preterm birth, and inflammation and oxidative stress may mediate these relationships. In a prospective cohort study of pregnant women recruited early in gestation in Northern Puerto Rico
M S Wolff et al.
Human reproduction (Oxford, England), 29(7), 1558-1566 (2014-05-02)
Does phthalate exposure during early childhood alter the timing of pubertal development in girls? Urinary concentrations of high-molecular weight phthalate (high-MWP) metabolites are associated with later pubarche. Phthalates are anti-androgenic environmental agents known to alter early development, with possible effects
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