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2-Propoxybenzoic acid

2-Propoxybenzoic acid structure

CAS No:
2100-31-4
Formula:
C10H12O3
Chemical Name:
2-Propoxybenzoic acid
Synonyms:
Benzoic acid,2-propoxy-;Benzoic acid,o-propoxy-;2-Propoxybenzoic acid;o-Propoxybenzoic acid;Salicylic acid propyl ether
Categories:
Pharmaceutical Intermediates > Cardiovascular Agents

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Description

Off-White Solid

2-Propoxybenzoic acid Basic Attributes

Molecular Weight：

180.2

Exact Mass：

180.20

BRN：

3089998

EC Number：

603-128-0

DSSTox ID：

DTXSID70337153

HScode：

2918990090

Characteristics

PSA：

46.5

XLogP3：

2.5

Density：

1.1±0.1 g/cm3

Melting Point：

99-100 °C

Boiling Point：

215 °C @ Press: 20 Torr

Flash Point：

120.0±13.9 °C

Refractive Index：

1.530

Vapor Pressure：

0.00034mmHg at 25°C

Safety Information

hazard class code：

36/37/38-22

safety instructions：

26-36-37

RTECS Number：

000-000-0

Marks：

Precautionary statement(s)：

P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, P501

Hazard Statements：

H315

GHS Classification：

|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 5 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

2-Propoxybenzoic acid Use and Manufacturing

2-Propoxybenzoic Acid is a salicylic acid derivative used in the preparation of inhibitors of tyrosinase or hyaluronidase. 2-Propoxybenzoic Acid is a very potent inhibitior of collagen-induced aggregation of human platelets

Computed Properties

Molecular Weight:180.20
XLogP3:2.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:180.078644241
Monoisotopic Mass:180.078644241
Topological Polar Surface Area:46.5
Heavy Atom Count:13
Complexity:168
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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2-Propoxybenzoic acid

CAS No.: 2100-31-4

Grade: industrial Grade

Content: 98%

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2-Propoxybenzoic acid

CAS No.: 2100-31-4

Content: 99.00%

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