Name: Name:1-(Benzo[d][1,3]dioxol-5-yl)propan-1-one
Brand: Angene
SKU: AG003BAR
Rating: 90 (10 reviews)

1-(Benzo[d][1,3]dioxol-5-yl)propan-1-one

CAS No.:

28281-49-4

Catalog Number:

AG003BAR

Molecular Formula:

C10H10O3

Molecular Weight:

178.1846

Pack Size

Purity

Availability

Location

Price(USD)

Quantity

97%

1 week

United States

$127

- +

25g

97%

1 week

United States

$305

- +

Product Description

Catalog Number:

AG003BAR

Chemical Name:

1-(Benzo[d][1,3]dioxol-5-yl)propan-1-one

CAS Number:

28281-49-4

Molecular Formula:

C10H10O3

Molecular Weight:

178.1846

MDL Number:

MFCD00016652

IUPAC Name:

1-(1,3-benzodioxol-5-yl)propan-1-one

InChI:

InChI=1S/C10H10O3/c1-2-8(11)7-3-4-9-10(5-7)13-6-12-9/h3-5H,2,6H2,1H3

InChI Key:

RVBJGSPBFIUTTR-UHFFFAOYSA-N

SMILES:

CCC(=O)c1ccc2c(c1)OCO2

EC Number:

248-937-6

UNII:

79S7K6SNO8

NSC Number:

29484

Properties

Complexity:

202

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

178.063g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

178.187g/mol

Monoisotopic Mass:

178.063g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

35.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.7

Literature

Title	Journal
Determination of synthesis route of 1-(3,4-methylenedioxyphenyl)-2-propanone (MDP-2-P) based on impurity profiles of MDMA.	Forensic science international 20050510

Properties