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1-Phenyl-3-hexanone

1-Phenyl-3-hexanone structure

CAS No:
29898-25-7
Formula:
C12H16O
Chemical Name:
1-Phenyl-3-hexanone
Synonyms:
3-Hexanone,1-phenyl-;1-Phenyl-3-hexanone;Phenethyl propyl ketone
Categories:
Pharmaceutical Intermediates > Bulk Drug Intermediates

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1-Phenyl-3-hexanone Basic Attributes

Molecular Weight：

176.25500

Exact Mass：

176.25

EC Number：

249-937-9

DSSTox ID：

DTXSID40184010

HScode：

2914399090

Characteristics

PSA：

17.07000

XLogP3：

2.98840

Appearance：

pale yellow to colorless liquid

Density：

0.9719 g/cm³ @ Temp: 40 °C

Boiling Point：

263 °C @ Press: 760 Torr

Refractive Index：

1.498

Vapor Pressure：

0.012mmHg at 25°C

Safety Information

GHS Classification：

|Danger|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P264, P270, P280, P301+P312, P305+P351+P338, P310, P330, and P501|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:176.25
XLogP3:2.7
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:5
Exact Mass:176.120115130
Monoisotopic Mass:176.120115130
Topological Polar Surface Area:17.1
Heavy Atom Count:13
Complexity:145
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Recommended Suppliers of 1-Phenyl-3-hexanone

HANGZHOU LEAP CHEM CO., LTD. Contact Supplier

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5 YRS

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Content: 99.00%

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Shanghai Qyubiotech Co., Ltd. Contact Supplier

CN
5 YRS

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Trader Supplier of Material intermediates,Pharmaceutical intermediates,Functional intermediates

1-Phenylhexan-3-one

CAS No.: 29898-25-7

Grade: Industrial Grade

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Honour Enterprise Company Limited Contact Supplier

CN
4 YRS

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Trader Supplier of Semaglutide,Tirzepatide,API,Enzyme

More than 15 years GMP Factory Suppy 99.5% 1-Phenylhexan-3-0ne Medical Grade CAS29898-25-7

CAS No.: 29898-25-7

Grade: Pharmaceutical Grade

Content: 99.5%

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