4-propylphenylboronic acid

4-propylphenylboronic acid

CAS: 134150-01-9

Formula: C9H13BO2

SMILES: CCCC1=CC=C(C=C1)B(O)O

IUPAC: (4-propylphenyl)boronic acid

InChI: InChI=1S/C9H13BO2/c1-2-3-8-4-6-9(7-5-8)10(11)12/h4-7,11-12H,2-3H2,1H3

Composition: C (65.91%), H (7.99%), B (6.59%), O (19.51%)

Molar Mass: 164.01

Atom Count: 25

Heavy Atom Count: 12

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	164.10086
Formal Charge	0
FSP3	0.33
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
InChIKey	WLCGYIWOKVWFLB-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	44.85
Topological Polar Surface Area	40.46
Polarizability	18.99
Ring Count	1
Rotatable Bond Count	3

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99.9%	<7 Days	134150-01-9		$14.03-$55.17$14.03$55.17

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95%	<7 Days	134150-01-9		$6.21-$322.92$6.21$7.25$9.32$19.67$68.31$322.92

Key Organics Ltd

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97%	<2 Days	134150-01-9		$51.35-$359.43$51.35$63.37$75.38$86.31$120.18$359.43

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98%	<6 Days	134150-01-9		$3.45-$6.90$3.45$5.75$6.90

Struchem co.,ltd

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98%	<5 Days	134150-01-9		$425.00$425.00

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95%	1 Day	134150-01-9		$555.66$555.66