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2-methylpyrimidine-4-carbaldehyde

2-methylpyrimidine-4-carbaldehyde

CAS: 1004-17-7

Formula: C6H6N2O

SMILES: CC1=NC(C=O)=CC=N1

IUPAC: 2-methylpyrimidine-4-carbaldehyde

InChI: InChI=1S/C6H6N2O/c1-5-7-3-2-6(4-9)8-5/h2-4H,1H3

Composition: C (59.01%), H (4.95%), N (22.94%), O (13.10%)

Molar Mass: 122.127

Atom Count: 15

Heavy Atom Count: 9

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 122.048012821
Formal Charge 0
FSP3 0.17
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 0
InChIKey BXHGNAADUUXBKK-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 33.55
Topological Polar Surface Area 42.85
Polarizability 12.22
Ring Count 1
Rotatable Bond Count 1

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Molecule Market Select
Purity LeadTime CAS PacketSize UnitPrice
95% <7 Days 1004-17-7 $190.90-$254.15$190.90$254.15
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AA BLOCKS INC
Purity LeadTime CAS PacketSize UnitPrice
95% <6 Days 1004-17-7 $140.30-$261.05$140.30$261.05
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Kinentia Biosciences LLC
Purity LeadTime CAS PacketSize UnitPrice
97% <14 Days 1004-17-7 $430.92$430.92
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Molecule Market Select
Purity LeadTime CAS PacketSize UnitPrice
95% <5 Days 1004-17-7 $172.76-$305.16$172.76$305.16
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ChemBridge Corp.
Purity LeadTime CAS PacketSize UnitPrice
95% <4 Days 1004-17-7 $125.35-$378.35$125.35$378.35
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