2-amino-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzaldehyde

2-amino-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzaldehyde

CAS: 1416722-69-4

Formula: C13H18BNO3

SMILES: CC1(C)OB(OC1(C)C)C1=CC=C(C=O)C(N)=C1

IUPAC: 2-amino-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzaldehyde

InChI: InChI=1S/C13H18BNO3/c1-12(2)13(3,4)18-14(17-12)10-6-5-9(8-16)11(15)7-10/h5-8H,15H2,1-4H3

Composition: C (63.19%), H (7.34%), B (4.37%), N (5.67%), O (19.42%)

Molar Mass: 247.1

Atom Count: 36

Heavy Atom Count: 18

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	247.137973
Formal Charge	0
FSP3	0.46
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	LYNXYMXUSJJFCK-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	67
Topological Polar Surface Area	61.55
Polarizability	27.03
Ring Count	2
Rotatable Bond Count	2

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Purity	LeadTime	CAS	PacketSize	UnitPrice
97%	<5 Days	1416722-69-4		$60.53-$287.51$60.53$108.45$287.51