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CAS 1204-79-1 4-AMINO-4′-HYDROXYBIPHENYL molecular structure lightbox
CAS RN: 1204-79-1

4-AMINO-4′-HYDROXYBIPHENYL

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5 package records4 with current stock2 grade groups
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260624 100mg In stock Inquiry
Batchno.20251130 1g In stock Inquiry
Batchno.20260526 250mg In stock Inquiry
Batchno.20260520 5g In stock Inquiry
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20251124 100mg / 250mg / 1g / 5g Out of stock 8-10 business days Inquiry
  • Product code: starshine_CAS1204-79-1
  • Purity/Analytical Methods: >99.0%
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1204-79-1 / 4-(4-aminophenyl)phenol

4-Amino-4'-hydroxybiphenyl | 4'-amino-[1,1'-biphenyl]-4-ol | 4'-aminobiphenyl-4-ol

Standard CAS: 1204-79-1 Multi CAS: Yes
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
1204-79-1
Multi CAS
Yes
Molecular Formula
C12H11NO
Molecular Weight
185.220000
Exact Mass
185.084064
SMILES
C1=CC(=CC=C1C2=CC=C(C=C2)O)N
InChI
InChI=1S/C12H11NO/c13-11-5-1-9(2-6-11)10-3-7-12(14)8-4-10/h1-8,14H,13H2
InChIKey
LQZZZAFQKXTFKH-UHFFFAOYSA-N
Synonyms
4-Amino-4'-hydroxybiphenyl 4'-amino-[1,1'-biphenyl]-4-ol 4'-aminobiphenyl-4-ol 4-(4-aminophenyl)phenol (1,1'-Biphenyl)-4-ol, 4'-amino-

Computed Properties

Structural Parameters

Heavy atom count
14
Aromatic heavy atom count
12
Rotatable bonds
1
H-bond acceptors
2
H-bond donors
2
Molar refractivity
57.96
TPSA
46.25

LogP / Solubility

WLOGP
2.64
MLOGP
2.32
XLogP3
1.7
Consensus LogP
2.22
Log S (ESOL)
-3.22
Class (ESOL)
Poorly soluble
Log S (Ali)
-2.99
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-3.18
Class (SILICOS-IT)
Poorly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.97

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5

Safety & Transport

Pictogram(s)
Irritant
Signal
Warning
GHS Hazard Statements
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] H312 (100%): Harmful in contact with skin [Warning Acute toxicity, dermal] H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] H332 (100%): Harmful if inhaled [Warning Acute toxicity, inhalation]
Precautionary Statement Codes
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501

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